A2314/0097650
TL;DR: A2314/0097650 (CAS 372970-67-7) is a chemical compound with molecular formula C17H13Cl2N3OS2 and molecular weight 408.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]benzamide
Also Known As: A2314/0097650, 2,4-dichloro-N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]benzamide, 2,4-dichloro-N-((3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)carbamothioyl)benzamide, 3-(3-CYANO-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHEN-2-YL)-1-(2,4-DICHLOROBENZOYL)THIOUREA
| Molecular Formula | C17H13Cl2N3OS2 |
|---|---|
| Molecular Weight | 408.99 g/mol |
| LogP | 4.93218 |
| Topological Polar Surface Area | 64.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 408.9877 |
| Heavy Atoms | 25 |
| Complexity | 902.02844 |
Chemical Identifiers
| CAS Number | 372970-67-7 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=S)NC(=O)C3=C(C=C(C=C3)Cl)Cl)C#N |
Product Overview
A2314/0097650 (CAS 372970-67-7), with molecular formula C17H13Cl2N3OS2 and molecular weight 408.99 g/mol. IUPAC: 2,4-dichloro-N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]benzamide.
Chemical Property Profile of A2314/0097650
Property Insights of A2314/0097650
The XLogP value of 4.93218 indicates that A2314/0097650 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.92 Ų falls within the moderate polarity range, balancing permeability and solubility for A2314/0097650. Following Lipinski's Rule of Five, A2314/0097650 has 2 hydrogen bond donor(s) and 4 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 A2314/0097650?
The CAS number of A2314/0097650 is 372970-67-7.
What is the molecular formula of A2314/0097650?
The molecular formula of A2314/0097650 is C17H13Cl2N3OS2.
What is the molecular weight of A2314/0097650?
The molecular weight of A2314/0097650 is 408.99 g/mol.
Where can I buy A2314/0097650?
You can request a quote for A2314/0097650 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2314/0097650?
Yes, KEHONG BIO provides custom synthesis services for A2314/0097650 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.