![9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine structure](/static/products/7207/72071-17-1.webp)
9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine
TL;DR: 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine (CAS 72071-17-1) is a chemical compound with molecular formula C14H21N5O4S and molecular weight 355.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(hydroxymethyl)-5-[6-(propan-2-ylsulfanylmethylamino)purin-9-yl]oxolane-3,4-diol
Also Known As: 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine, 2-(hydroxymethyl)-5-[6-(propan-2-ylsulfanylmethylamino)purin-9-yl]oxolane-3,4-diol
| Molecular Formula | C14H21N5O4S |
|---|---|
| Molecular Weight | 355.13 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 151.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.13144 |
| Heavy Atoms | 24 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 72071-17-1 |
|---|---|
| SMILES | CC(C)SCNC1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)CO)O)O |
| InChIKey | ZWPVCWFFRVNBQU-UHFFFAOYSA-N |
Product Overview
9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine (CAS 72071-17-1), with molecular formula C14H21N5O4S and molecular weight 355.13 g/mol. IUPAC: 2-(hydroxymethyl)-5-[6-(propan-2-ylsulfanylmethylamino)purin-9-yl]oxolane-3,4-diol.
Chemical Property Profile of 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine
Property Insights of 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine. The TPSA of 151.0 Ų indicates high polarity, suggesting 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine has 4 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 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine?
The CAS number of 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine is 72071-17-1.
What is the molecular formula of 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine?
The molecular formula of 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine is C14H21N5O4S.
What is the molecular weight of 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine?
The molecular weight of 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine is 355.13 g/mol.
Where can I buy 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine?
You can request a quote for 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine?
Yes, KEHONG BIO provides custom synthesis services for 9-Pentofuranosyl-N-{[(propan-2-yl)sulfanyl]methyl}-9H-purin-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.