![(1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol structure](/static/products/202/202267-59-2.png)
(1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol
TL;DR: (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol (CAS 202267-59-2) is a chemical compound with molecular formula C21H25N7O5 and molecular weight 455.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R,3R,5R)-3-(hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)pyrrolidin-3-yl]amino]purin-9-yl]cyclopentane-1,2-diol
Also Known As: (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol
| Molecular Formula | C21H25N7O5 |
|---|---|
| Molecular Weight | 455.19 g/mol |
| LogP | 0.7004 |
| Topological Polar Surface Area | 162.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 455.1917 |
| Heavy Atoms | 33 |
| Complexity | 1153.616 |
Chemical Identifiers
| CAS Number | 202267-59-2 |
|---|---|
| SMILES | C1CN(C[C@H]1NC2=C3C(=NC=N2)N(C=N3)[C@@H]4C[C@@H]([C@H]([C@H]4O)O)CO)C5=CC=C(C=C5)[N+](=O)[O-] |
Product Overview
(1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol (CAS 202267-59-2), with molecular formula C21H25N7O5 and molecular weight 455.19 g/mol. IUPAC: (1S,2R,3R,5R)-3-(hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)pyrrolidin-3-yl]amino]purin-9-yl]cyclopentane-1,2-diol.
Chemical Property Profile of (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol
Property Insights of (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol
The XLogP value of 0.7004 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol. The TPSA of 162.7 Ų indicates high polarity, suggesting (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol?
The CAS number of (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol is 202267-59-2.
What is the molecular formula of (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol?
The molecular formula of (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol is C21H25N7O5.
What is the molecular weight of (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol?
The molecular weight of (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol is 455.19 g/mol.
Where can I buy (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol?
You can request a quote for (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol?
Yes, KEHONG BIO provides custom synthesis services for (1S,2R,3R,5R)-3-(Hydroxymethyl)-5-[6-[[(3S)-1-(4-nitrophenyl)-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.