AB00685853-01
TL;DR: AB00685853-01 (CAS 864858-79-7) is a chemical compound with molecular formula C24H17N3O4S and molecular weight 443.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-3-oxobenzo[f]chromene-2-carboxamide
Also Known As: AB00685853-01, F1298-0878, N-(6-acetyl-3-cyano-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-3-oxo-3H-benzo[f]chromene-2-carboxamide, N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-3-oxobenzo[f]chromene-2-carboxamide, N-{6-acetyl-3-cyano-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl}-3-oxo-3H-benzo[f]chromene-2-carboxamide
| Molecular Formula | C24H17N3O4S |
|---|---|
| Molecular Weight | 443.09 g/mol |
| LogP | 4.03628 |
| Topological Polar Surface Area | 103.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 443.09396 |
| Heavy Atoms | 32 |
| Complexity | 1526.3103 |
Chemical Identifiers
| CAS Number | 864858-79-7 |
|---|---|
| SMILES | CC(=O)N1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC4=C(C=CC5=CC=CC=C54)OC3=O |
Product Overview
AB00685853-01 (CAS 864858-79-7), with molecular formula C24H17N3O4S and molecular weight 443.09 g/mol. IUPAC: N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-3-oxobenzo[f]chromene-2-carboxamide.
Chemical Property Profile of AB00685853-01
Property Insights of AB00685853-01
The XLogP value of 4.03628 indicates that AB00685853-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.41 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00685853-01. Following Lipinski's Rule of Five, AB00685853-01 has 1 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 AB00685853-01?
The CAS number of AB00685853-01 is 864858-79-7.
What is the molecular formula of AB00685853-01?
The molecular formula of AB00685853-01 is C24H17N3O4S.
What is the molecular weight of AB00685853-01?
The molecular weight of AB00685853-01 is 443.09 g/mol.
Where can I buy AB00685853-01?
You can request a quote for AB00685853-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00685853-01?
Yes, KEHONG BIO provides custom synthesis services for AB00685853-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.