6-Chloro-4-thiophen-2-ylchromen-2-one
TL;DR: 6-Chloro-4-thiophen-2-ylchromen-2-one (CAS 380847-72-3) is a chemical compound with molecular formula C13H7ClO2S and molecular weight 261.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-4-thiophen-2-ylchromen-2-one
Also Known As: ICCB4_000176, 6-chloro-4-thiophen-2-ylchromen-2-one, 6-chloro-4-(thiophen-2-yl)-2H-chromen-2-one, J1.695.161G, 4-(2-Thienyl)-6-chloro-2H-1-benzopyran-2-one
| Molecular Formula | C13H7ClO2S |
|---|---|
| Molecular Weight | 261.99 g/mol |
| LogP | 4.1749 |
| Topological Polar Surface Area | 30.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 261.98553 |
| Heavy Atoms | 17 |
| Complexity | 728.75934 |
Chemical Identifiers
| CAS Number | 380847-72-3 |
|---|---|
| SMILES | C1=CSC(=C1)C2=CC(=O)OC3=C2C=C(C=C3)Cl |
Product Overview
6-Chloro-4-thiophen-2-ylchromen-2-one (CAS 380847-72-3), with molecular formula C13H7ClO2S and molecular weight 261.99 g/mol. IUPAC: 6-chloro-4-thiophen-2-ylchromen-2-one.
Chemical Property Profile of 6-Chloro-4-thiophen-2-ylchromen-2-one
Property Insights of 6-Chloro-4-thiophen-2-ylchromen-2-one
The XLogP value of 4.1749 indicates that 6-Chloro-4-thiophen-2-ylchromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.21 Ų, 6-Chloro-4-thiophen-2-ylchromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-4-thiophen-2-ylchromen-2-one has 0 hydrogen bond donor(s) and 3 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 6-Chloro-4-thiophen-2-ylchromen-2-one?
The CAS number of 6-Chloro-4-thiophen-2-ylchromen-2-one is 380847-72-3.
What is the molecular formula of 6-Chloro-4-thiophen-2-ylchromen-2-one?
The molecular formula of 6-Chloro-4-thiophen-2-ylchromen-2-one is C13H7ClO2S.
What is the molecular weight of 6-Chloro-4-thiophen-2-ylchromen-2-one?
The molecular weight of 6-Chloro-4-thiophen-2-ylchromen-2-one is 261.99 g/mol.
Where can I buy 6-Chloro-4-thiophen-2-ylchromen-2-one?
You can request a quote for 6-Chloro-4-thiophen-2-ylchromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-4-thiophen-2-ylchromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-4-thiophen-2-ylchromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.