3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one
TL;DR: 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one (CAS 35814-28-9) is a chemical compound with molecular formula C15H12OS and molecular weight 240.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-2,3-dihydrothiochromen-4-one
Also Known As: thioisoflavanone, 3-Phenylthiochroman-4-one, 3-phenyl-2,3-dihydrothiochromen-4-one, 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one, RefChem:281714
| Molecular Formula | C15H12OS |
|---|---|
| Molecular Weight | 240.06 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 240.06088 |
| Heavy Atoms | 17 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 35814-28-9 |
|---|---|
| SMILES | C1C(C(=O)C2=CC=CC=C2S1)C3=CC=CC=C3 |
| InChIKey | PIDNYUZTTLQVDW-UHFFFAOYSA-N |
Product Overview
3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one (CAS 35814-28-9), with molecular formula C15H12OS and molecular weight 240.06 g/mol. IUPAC: 3-phenyl-2,3-dihydrothiochromen-4-one.
Chemical Property Profile of 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one
Property Insights of 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one
The XLogP value of 3.6 indicates that 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.4 Ų, 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one 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 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one?
The CAS number of 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one is 35814-28-9.
What is the molecular formula of 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one?
The molecular formula of 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one is C15H12OS.
What is the molecular weight of 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one?
The molecular weight of 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one is 240.06 g/mol.
Where can I buy 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one?
You can request a quote for 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenyl-2,3-dihydro-4H-1-benzothiopyran-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.