![4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]- structure](/static/products/1403/140381-13-1.webp)
4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]-
TL;DR: 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]- (CAS 140381-13-1) is a chemical compound with molecular formula C16H11ClOS and molecular weight 286.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-chlorophenyl)methyl]thiochromen-4-one
Also Known As: 3-[(4-chlorophenyl)methyl]thiochromen-4-one, 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]-, J1.633.860E, 3-(4-Chlorobenzyl)-4H-1-benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]-4H-thiochromen-4-one
| Molecular Formula | C16H11ClOS |
|---|---|
| Molecular Weight | 286.02 g/mol |
| LogP | 4.5057 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.0219 |
| Heavy Atoms | 19 |
| Complexity | 774.60596 |
Chemical Identifiers
| CAS Number | 140381-13-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=CS2)CC3=CC=C(C=C3)Cl |
Product Overview
4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]- (CAS 140381-13-1), with molecular formula C16H11ClOS and molecular weight 286.02 g/mol. IUPAC: 3-[(4-chlorophenyl)methyl]thiochromen-4-one.
Chemical Property Profile of 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]-
Property Insights of 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]-
The XLogP value of 4.5057 indicates that 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]- has 0 hydrogen bond donor(s) and 2 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 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]-?
The CAS number of 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]- is 140381-13-1.
What is the molecular formula of 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]-?
The molecular formula of 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]- is C16H11ClOS.
What is the molecular weight of 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]-?
The molecular weight of 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]- is 286.02 g/mol.
Where can I buy 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]-?
You can request a quote for 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]-?
Yes, KEHONG BIO provides custom synthesis services for 4H-1-Benzothiopyran-4-one, 3-[(4-chlorophenyl)methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.