C43H55N4O10P Uridine, 5′-O- [bis (4-methoxyphenyl) phenylmethyl] -2′ -O- (2-methox yethyl) - 5-methyl-, 3′ – [2-cyanoethyl N, N-bis (1-) methylethyl) phosphor amidite (ACI)

ngwaahịa

C43H55N4O10P Uridine, 5′-O- [bis (4-methoxyphenyl) phenylmethyl] -2′ -O- (2-methox yethyl) - 5-methyl-, 3′ – [2-cyanoethyl N, N-bis (1-) methylethyl) phosphor amidite (ACI)

Ozi bụ isi:


Nkọwa ngwaahịa

Mkpado ngwaahịa

Nkọwa ihe

Nọmba ndekọ CAS

163878-63-5

H302

Njirimara anụ ahụ igodo Uru Ọnọdụ
Ibu molekụla 818.89 -
pKa (buru amụma) 9.55±0.10 Okpomọkụ kachasị acidic: 25 Celsius

Aha ndị ọzọ na njirimara

Ọchịchị Canonical

N#CCCOP(OC1C(OC(N2C=C(C(=O) NC2=O)C)C1OCCOC)COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5= CC=C(OC)C=C5)N(C(C)C)C(C)C

Isomeric SMILES

C(OC[C@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](OCCOC)[C@@ H](O1)N2C(=O)NC(=O)C(C)=C2)(C3=CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5= CC=CC=C5

InChi

InChi= 1S/C43H55N4O10P/c1-29(2)47(30(3)4)58(55-24-12-23-44)57-38-37(56-41(39(38)53-26- 25-50-6)46-27-31(5)40(48)45-42(46)49)2 8-54-43(32-13-10-9-11-14-32,33-15) -19-35(51-7)20-16-33)34-17-21-36(52-8)22-18-34/h9-11,13-22,27,29-30,37-39 ,41H,12,24-26,28H2, 1-8H3,(H,45,48,49)/t37-,38-,39-,41-,58?/m1/s1

Igodo InChi

YFRRKZDUDXHJNC-KZQAAKLLSA-N

17 Aha ndị ọzọ maka ihe a

Uridine, 5 '-O- [bis (4-methoxyphenyl) phenylmethyl] -2′ -O(2-methoxyethyl) - 5-methyl-, 3′ - [2-cyanoethyl bis (1-methylethyl) phosphor.

amide] (9CI); 10: PN: US20030212017 PEEJI: 18 kwuru RNA; 11: PN: US20030211606 PEEJI: 18 kwuru RNA; 13: PN: US20040

005569 PEEJI: 21 RNA kwuru; 13: PN: US20040006030 PEEJI: 22 kwuru RNA; 13: PN: US20040014048 PEEJI: 19 kwuru RNA; 13: PN: US20040014049 PEEJI: 19 kwuru RNA; 14: PN: US20030198965 PEEJI: 19 kwuru RNA; 14: PN: US20040005565 PEEJI: 17- 22 kwuru RNA; 14: PN: US20040005570 PEEJI: 19 kwuru RNA; 14: PN: US20040014047 PEEJI: 19 kwuru RNA; 14: PN: US20040

014699 PEEJI: 19 RNA kwuru; 15: PN: US20040014050 PEEJI: 19 kwuru RNA; 15: PN: US20040014051 PEEJI: 21 kwuru RNA; 15:

PN: WO03106645 PEEJI: 69 kwuru RNA; 16: PN: US20040006029 PEEJI: 22 kwuru RNA; 87: PN: US20040005707 PEEJI: 19 kwuru RNA

Spectra nnwale

Spectra dị
1H NMR
13C NMR
Hetero NMR

Njirimara amụma

Ngwongwo dị
Usoro ndu
Chemical
Lipinski
Ọdịdị metụtara

Usoro ndu

Ngwongwo Uru Ọnọdụ Isi mmalite
Ihe kpatara bioconcentration 348 pH 1; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 2810 pH 2; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 21100 pH 3; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 63100 pH 4; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 78800 pH 5; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 80800 pH 6; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 80800 pH 7; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 78800 pH 8; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 63400 pH 9; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 21800 pH 10; Okpomọkụ: 25 Celsius C (1) ACD

(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Chemical

Ngwongwo Uru Ọnọdụ Isi mmalite
Koc 487 pH 1; Okpomọkụ: 25 Celsius C (1) ACD
Koc 3940 pH 2; Okpomọkụ: 25 Celsius C (1) ACD
Koc 29600 pH 3; Okpomọkụ: 25 Celsius C (1) ACD
Koc 88400 pH 4; Okpomọkụ: 25 Celsius C (1) ACD

 

Ngwongwo Uru Ọnọdụ Isi mmalite
Koc 1.10 x 105 pH 5; Okpomọkụ: 25 Celsius C (1) ACD
Koc 1.13 x 105 pH 6; Okpomọkụ: 25 Celsius C (1) ACD
Koc 1.13 x 105 pH 7; Okpomọkụ: 25 Celsius C (1) ACD
Koc 1.10 x 105 pH 8; Okpomọkụ: 25 Celsius C (1) ACD
Koc 88800 pH 9; Okpomọkụ: 25 Celsius C (1) ACD
Koc 30600 pH 10; Okpomọkụ: 25 Celsius C (1) ACD
logD 4.39 pH 1; Okpomọkụ: 25 Celsius C (1) ACD
logD 5.30 pH 2; Okpomọkụ: 25 Celsius C (1) ACD
logD 6.18 pH 3; Okpomọkụ: 25 Celsius C (1) ACD
logD 6.65 pH 4; Okpomọkụ: 25 Celsius C (1) ACD
logD 6.75 pH 5; Okpomọkụ: 25 Celsius C (1) ACD
logD 6.76 pH 6; Okpomọkụ: 25 Celsius C (1) ACD
logD 6.76 pH 7; Okpomọkụ: 25 Celsius C (1) ACD
logD 6.75 pH 8; Okpomọkụ: 25 Celsius C (1) ACD
logD 6.65 pH 9; Okpomọkụ: 25 Celsius C (1) ACD
logD 6.19 pH 10; Okpomọkụ: 25 Celsius C (1) ACD
logP 6.761± 0.669 Okpomọkụ: 25 Celsius C (1) ACD
Ọkachamara Solubility dị n'ime 2.0 x 10-4 g/L Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 0.046 g/L pH 1; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 5.7 x 10-3 g/L pH 2; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 7.6 x 10-4 g/L pH 3; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 2.5 x 10-4 g/L pH 4; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 2.0 x 10-4 g/L pH 5; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 2.0 x 10-4 g/L pH 6; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 2.0 x 10-4 g/L pH 7; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 2.0 x 10-4 g/L pH 8; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 2.5 x 10-4 g/L pH 9; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 7.4 x 10-4 g/L pH 10; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 2.0 x 10-4 g/L Mmiri na-enweghị atụ pH 7.00; Okpomọkụ: 25 Celsius C (1) ACD
Solubility dị n'ime Molar 2.4 x 10-7 mol / l Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 5.6 x 10-5 mol / l pH 1; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 7.0 x 10-6 mol/L pH 2; Okpomọkụ: 25 Celsius C (1) ACD

 

Ngwongwo Uru Ọnọdụ Isi mmalite
Solubility Molar 9.3 x 10-7 mol/L pH 3; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 3.1 x 10-7 mol/L pH 4; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 2.5 x 10-7 mol / l pH 5; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 2.4 x 10-7 mol / l pH 6; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 2.4 x 10-7 mol / l pH 7; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 2.5 x 10-7 mol / l pH 8; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 3.1 x 10-7 mol/L pH 9; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 9.0 x 10-7 mol/L pH 10; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 2.4 x 10-7 mol / l Mmiri na-enweghị atụ pH 7.00; Okpomọkụ: 25 Celsius C (1) ACD
Ibu molekụla 818.89    
pKa 9.55±0.10 Okpomọkụ kachasị acidic: 25 Celsius (1) ACD
pKa 3.45± 0.70 Okpomọkụ kachasị mma: 25 Celsius (1) ACD

(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Ngwongwo Uru Ọnọdụ Isi mmalite
Nkwekọrịta na-agbanwe agbanwe n'efu 21   (1) ACD
H Ndị nnabata 14   (1) ACD
H Ndị na-enye onyinye 1   (1) ACD
H Donor/Anabata Nchikota 15   (1) ACD
logP 6.761± 0.669 Okpomọkụ: 25 Celsius C (1) ACD
Ibu molekụla 818.89    

(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Ọdịdị metụtara

Ngwongwo Uru Isi mmalite ọnọdụ
Mpaghara elu elu 164 A2 (1) ACD

(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Spectra buru amụma

Spectra dị
1H NMR
13C NMR

Nkwupụta egwu GHS

Isi mmalite nkwupụta egwu koodu
H302 na-emerụ ma ọ bụrụ na iloro ya European Chemical Agency (ECHA) nhazi ọkwa na akara aha

Ndepụta Ngwaahịa - Nhazi ọkwa na ntinye aha - ọkwa kachasị, European Chemical Agency (ECHA)

Nhazi&Ngwakọta aha - Nhazi ọkwa na ntinye aha - ọkwa kacha njọ


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