1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone
TL;DR: 1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone (CAS 2588-51-4) is a chemical compound with molecular formula C15H12N4OS and molecular weight 296.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-2-(1-phenyltetrazol-5-yl)sulfanylethanone
Also Known As: ChemDiv3_001737, CHEMBRDG-BB5217042, 2-[1]naphthyl-1-phenyl-ethanone, CHEMBRDG-BB 5217042, 1-phenyl-2-(1-phenyltetrazol-5-yl)sulfanylethanone
| Molecular Formula | C15H12N4OS |
|---|---|
| Molecular Weight | 296.07 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 86.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.07318 |
| Heavy Atoms | 21 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 2588-51-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CSC2=NN=NN2C3=CC=CC=C3 |
| InChIKey | JRSLAXDKWLZOMY-UHFFFAOYSA-N |
Product Overview
1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone (CAS 2588-51-4), with molecular formula C15H12N4OS and molecular weight 296.07 g/mol. IUPAC: 1-phenyl-2-(1-phenyltetrazol-5-yl)sulfanylethanone.
Chemical Property Profile of 1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone
Property Insights of 1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone
The XLogP value of 3.5 indicates that 1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone. Following Lipinski's Rule of Five, 1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone has 0 hydrogen bond donor(s) and 5 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 1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone?
The CAS number of 1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone is 2588-51-4.
What is the molecular formula of 1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone?
The molecular formula of 1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone is C15H12N4OS.
What is the molecular weight of 1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone?
The molecular weight of 1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone is 296.07 g/mol.
Where can I buy 1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone?
You can request a quote for 1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanyl)-ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.