AB00137841-02
TL;DR: AB00137841-02 (CAS 361478-82-2) is a chemical compound with molecular formula C19H14N2O3S and molecular weight 350.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-oxochromene-2-carboxamide
Also Known As: AB00137841-02, AB00137841-03, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-oxo-4H-chromene-2-carboxamide, F0463-0254, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-oxochromene-2-carboxamide
| Molecular Formula | C19H14N2O3S |
|---|---|
| Molecular Weight | 350.07 g/mol |
| LogP | 3.85728 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 350.0725 |
| Heavy Atoms | 25 |
| Complexity | 1088.2228 |
Chemical Identifiers
| CAS Number | 361478-82-2 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=O)C4=CC=CC=C4O3)C#N |
Product Overview
AB00137841-02 (CAS 361478-82-2), with molecular formula C19H14N2O3S and molecular weight 350.07 g/mol. IUPAC: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-oxochromene-2-carboxamide.
Chemical Property Profile of AB00137841-02
Property Insights of AB00137841-02
The XLogP value of 3.85728 indicates that AB00137841-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00137841-02. Following Lipinski's Rule of Five, AB00137841-02 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 AB00137841-02?
The CAS number of AB00137841-02 is 361478-82-2.
What is the molecular formula of AB00137841-02?
The molecular formula of AB00137841-02 is C19H14N2O3S.
What is the molecular weight of AB00137841-02?
The molecular weight of AB00137841-02 is 350.07 g/mol.
Where can I buy AB00137841-02?
You can request a quote for AB00137841-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00137841-02?
Yes, KEHONG BIO provides custom synthesis services for AB00137841-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.