喷司他丁
TL;DR: 喷司他丁 (CAS 63677-95-2) is a chemical compound with molecular formula C11H16N4O4 and molecular weight 268.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
喷司他丁
(8R)-3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-8-ol
Also Known As: pentostatin, Deoxycoformycin, Nipent, 2'-Deoxycoformycin, CO-Vidarabine
| Molecular Formula | C11H16N4O4 |
|---|---|
| Molecular Weight | 268.12 g/mol |
| LogP | -2.1 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.11716 |
| Heavy Atoms | 19 |
| Complexity | 356.0 |
Chemical Identifiers
| CAS Number | 63677-95-2 |
|---|---|
| SMILES | C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC=NC[C@H]3O)CO)O |
| InChIKey | FPVKHBSQESCIEP-JQCXWYLXSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
喷司他丁 (CAS 63677-95-2), with molecular formula C11H16N4O4 and molecular weight 268.12 g/mol. IUPAC: (8R)-3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-8-ol.
Chemical Property Profile of 喷司他丁
Property Insights of 喷司他丁
The XLogP value of -2.1 indicates that 喷司他丁 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 喷司他丁. Following Lipinski's Rule of Five, 喷司他丁 has 4 hydrogen bond donor(s) and 6 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 喷司他丁?
The CAS number of 喷司他丁 is 63677-95-2.
What is the molecular formula of 喷司他丁?
The molecular formula of 喷司他丁 is C11H16N4O4.
What is the molecular weight of 喷司他丁?
The molecular weight of 喷司他丁 is 268.12 g/mol.
Where can I buy 喷司他丁?
You can request a quote for 喷司他丁 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 喷司他丁?
Yes, KEHONG BIO provides custom synthesis services for 喷司他丁 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.