MixCom6_001268
TL;DR: MixCom6_001268 (CAS 314022-12-3) is a chemical compound with molecular formula C17H13ClN2OS2 and molecular weight 360.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-1-benzothiophene-2-carboxamide
Also Known As: MixCom6_001268, BAS 00355621, BIM-0024095.P001, AB01332402-02, 3-chloro-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-1-benzothiophene-2-carboxamide
| Molecular Formula | C17H13ClN2OS2 |
|---|---|
| Molecular Weight | 360.02 g/mol |
| LogP | 5.611 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 360.01578 |
| Heavy Atoms | 23 |
| Complexity | 949.54865 |
Chemical Identifiers
| CAS Number | 314022-12-3 |
|---|---|
| SMILES | CCC1=C(SC(=C1C#N)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C |
Product Overview
MixCom6_001268 (CAS 314022-12-3), with molecular formula C17H13ClN2OS2 and molecular weight 360.02 g/mol. IUPAC: 3-chloro-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-1-benzothiophene-2-carboxamide.
Chemical Property Profile of MixCom6_001268
Property Insights of MixCom6_001268
The XLogP value of 5.611 indicates that MixCom6_001268 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, MixCom6_001268 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, MixCom6_001268 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of MixCom6_001268?
The CAS number of MixCom6_001268 is 314022-12-3.
What is the molecular formula of MixCom6_001268?
The molecular formula of MixCom6_001268 is C17H13ClN2OS2.
What is the molecular weight of MixCom6_001268?
The molecular weight of MixCom6_001268 is 360.02 g/mol.
Where can I buy MixCom6_001268?
You can request a quote for MixCom6_001268 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MixCom6_001268?
Yes, KEHONG BIO provides custom synthesis services for MixCom6_001268 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.