MixCom6_000747
TL;DR: MixCom6_000747 (CAS 314022-95-2) is a chemical compound with molecular formula C13H10ClN3OS3 and molecular weight 354.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1-benzothiophene-2-carboxamide
Also Known As: MixCom6_000747, DivK1c_005179, CDS1_004139, BAS 00540609, BIM-0023680.P001
| Molecular Formula | C13H10ClN3OS3 |
|---|---|
| Molecular Weight | 354.97 g/mol |
| LogP | 4.7705 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.96747 |
| Heavy Atoms | 21 |
| Complexity | 798.91473 |
Chemical Identifiers
| CAS Number | 314022-95-2 |
|---|---|
| SMILES | CCSC1=NN=C(S1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl |
Product Overview
MixCom6_000747 (CAS 314022-95-2), with molecular formula C13H10ClN3OS3 and molecular weight 354.97 g/mol. IUPAC: 3-chloro-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1-benzothiophene-2-carboxamide.
Chemical Property Profile of MixCom6_000747
Property Insights of MixCom6_000747
The XLogP value of 4.7705 indicates that MixCom6_000747 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, MixCom6_000747 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, MixCom6_000747 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 MixCom6_000747?
The CAS number of MixCom6_000747 is 314022-95-2.
What is the molecular formula of MixCom6_000747?
The molecular formula of MixCom6_000747 is C13H10ClN3OS3.
What is the molecular weight of MixCom6_000747?
The molecular weight of MixCom6_000747 is 354.97 g/mol.
Where can I buy MixCom6_000747?
You can request a quote for MixCom6_000747 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MixCom6_000747?
Yes, KEHONG BIO provides custom synthesis services for MixCom6_000747 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.