AB01278732-01
TL;DR: AB01278732-01 (CAS 897454-24-9) is a chemical compound with molecular formula C16H15ClFN5O3S and molecular weight 411.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-fluorophenyl)-2-(1,3,9-trimethyl-2,6-dioxopurin-8-yl)sulfanylacetamide
Also Known As: AB01278732-01, F2599-0130, N-(3-chloro-4-fluorophenyl)-2-[(1,3,9-trimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide, N-(3-chloro-4-fluorophenyl)-2-(1,3,9-trimethyl-2,6-dioxopurin-8-yl)sulfanylacetamide, N-(3-chloro-4-fluorophenyl)-2-((1,3,9-trimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl)thio)acetamide
| Molecular Formula | C16H15ClFN5O3S |
|---|---|
| Molecular Weight | 411.06 g/mol |
| LogP | 1.494 |
| Topological Polar Surface Area | 90.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 411.05682 |
| Heavy Atoms | 27 |
| Complexity | 1183.4832 |
Chemical Identifiers
| CAS Number | 897454-24-9 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C(=O)N2C)C)N=C1SCC(=O)NC3=CC(=C(C=C3)F)Cl |
Product Overview
AB01278732-01 (CAS 897454-24-9), with molecular formula C16H15ClFN5O3S and molecular weight 411.06 g/mol. IUPAC: N-(3-chloro-4-fluorophenyl)-2-(1,3,9-trimethyl-2,6-dioxopurin-8-yl)sulfanylacetamide.
Chemical Property Profile of AB01278732-01
Property Insights of AB01278732-01
The XLogP value of 1.494 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01278732-01. The TPSA of 90.92 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01278732-01. Following Lipinski's Rule of Five, AB01278732-01 has 1 hydrogen bond donor(s) and 5 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 AB01278732-01?
The CAS number of AB01278732-01 is 897454-24-9.
What is the molecular formula of AB01278732-01?
The molecular formula of AB01278732-01 is C16H15ClFN5O3S.
What is the molecular weight of AB01278732-01?
The molecular weight of AB01278732-01 is 411.06 g/mol.
Where can I buy AB01278732-01?
You can request a quote for AB01278732-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01278732-01?
Yes, KEHONG BIO provides custom synthesis services for AB01278732-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.