2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone
TL;DR: 2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone (CAS 352564-79-5) is a chemical compound with molecular formula C21H15NO2S and molecular weight 345.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone
Also Known As: 2-(1,3-benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone, [(Benzoxazole-2-ylthio)phenylacetyl]benzene, J2.557.953D, 2-benzoxazol-2-ylthio-1,2-diphenylethan-1-one, AI-020/37280015
| Molecular Formula | C21H15NO2S |
|---|---|
| Molecular Weight | 345.08 g/mol |
| LogP | 5.5441 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 345.08234 |
| Heavy Atoms | 25 |
| Complexity | 963.0375 |
Chemical Identifiers
| CAS Number | 352564-79-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)SC3=NC4=CC=CC=C4O3 |
Product Overview
2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone (CAS 352564-79-5), with molecular formula C21H15NO2S and molecular weight 345.08 g/mol. IUPAC: 2-(1,3-benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone.
Chemical Property Profile of 2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone
Property Insights of 2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone
The XLogP value of 5.5441 indicates that 2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.1 Ų, 2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone has 0 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 2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone?
The CAS number of 2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone is 352564-79-5.
What is the molecular formula of 2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone?
The molecular formula of 2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone is C21H15NO2S.
What is the molecular weight of 2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone?
The molecular weight of 2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone is 345.08 g/mol.
Where can I buy 2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone?
You can request a quote for 2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-Benzoxazol-2-ylsulfanyl)-1,2-diphenylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.