AB00713792-01
TL;DR: AB00713792-01 (CAS 315696-97-0) is a chemical compound with molecular formula C22H20N4O4S3 and molecular weight 500.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5,6-dimethyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-sulfamoylphenyl)acetamide
Also Known As: AB00713792-01, 2-((5,6-dimethyl-4-oxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)thio)-N-(4-sulfamoylphenyl)acetamide, F1143-5844, 2-({5,6-dimethyl-4-oxo-3-phenyl-3H,4H-thieno[2,3-d]pyrimidin-2-yl}sulfanyl)-N-(4-sulfamoylphenyl)acetamide, 2-(5,6-dimethyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-sulfamoylphenyl)acetamide
| Molecular Formula | C22H20N4O4S3 |
|---|---|
| Molecular Weight | 500.06 g/mol |
| LogP | 3.44224 |
| Topological Polar Surface Area | 124.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 500.06467 |
| Heavy Atoms | 33 |
| Complexity | 1509.5298 |
Chemical Identifiers
| CAS Number | 315696-97-0 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=CC=C4)C |
Product Overview
AB00713792-01 (CAS 315696-97-0), with molecular formula C22H20N4O4S3 and molecular weight 500.06 g/mol. IUPAC: 2-(5,6-dimethyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-sulfamoylphenyl)acetamide.
Chemical Property Profile of AB00713792-01
Property Insights of AB00713792-01
The XLogP value of 3.44224 indicates that AB00713792-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.15 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00713792-01. Following Lipinski's Rule of Five, AB00713792-01 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00713792-01?
The CAS number of AB00713792-01 is 315696-97-0.
What is the molecular formula of AB00713792-01?
The molecular formula of AB00713792-01 is C22H20N4O4S3.
What is the molecular weight of AB00713792-01?
The molecular weight of AB00713792-01 is 500.06 g/mol.
Where can I buy AB00713792-01?
You can request a quote for AB00713792-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00713792-01?
Yes, KEHONG BIO provides custom synthesis services for AB00713792-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.