![(1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol structure](/static/products/202/202267-06-9.png)
(1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol
TL;DR: (1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol (CAS 202267-06-9) is a chemical compound with molecular formula C22H26F3N7O3 and molecular weight 493.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R,3R,5R)-3-(methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]pyrrolidin-3-yl]amino]purin-9-yl]cyclopentane-1,2-diol
Also Known As: (1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol, (1S,2R,3R,5R)-3-(methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)pyridin-2-yl]pyrrolidin-3-yl]amino]purin-9-yl]cyclopentane-1,2-diol
| Molecular Formula | C22H26F3N7O3 |
|---|---|
| Molecular Weight | 493.20 g/mol |
| LogP | 1.8601 |
| Topological Polar Surface Area | 121.45 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 493.20493 |
| Heavy Atoms | 35 |
| Complexity | 1173.306 |
Chemical Identifiers
| CAS Number | 202267-06-9 |
|---|---|
| SMILES | COC[C@H]1C[C@H]([C@@H]([C@@H]1O)O)N2C=NC3=C(N=CN=C32)N[C@H]4CCN(C4)C5=NC=C(C=C5)C(F)(F)F |
Product Overview
(1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol (CAS 202267-06-9), with molecular formula C22H26F3N7O3 and molecular weight 493.20 g/mol. IUPAC: (1S,2R,3R,5R)-3-(methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]pyrrolidin-3-yl]amino]purin-9-yl]cyclopentane-1,2-diol.
Chemical Property Profile of (1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol
Property Insights of (1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol
The XLogP value of 1.8601 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol. The TPSA of 121.45 Ų falls within the moderate polarity range, balancing permeability and solubility for (1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol. Following Lipinski's Rule of Five, (1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol has 3 hydrogen bond donor(s) and 9 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-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol?
The CAS number of (1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol is 202267-06-9.
What is the molecular formula of (1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol?
The molecular formula of (1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol is C22H26F3N7O3.
What is the molecular weight of (1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol?
The molecular weight of (1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol is 493.20 g/mol.
Where can I buy (1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol?
You can request a quote for (1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-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-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol?
Yes, KEHONG BIO provides custom synthesis services for (1S,2R,3R,5R)-3-(Methoxymethyl)-5-[6-[[(3S)-1-[5-(trifluoromethyl)-2-pyridinyl]-3-pyrrolidinyl]amino]-9H-purin-9-yl]-1,2-cyclopentanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.