![1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone structure](/static/products/2580/25803-68-3.webp)
1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone
TL;DR: 1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone (CAS 25803-68-3) is a chemical compound with molecular formula C10H10N4OS and molecular weight 234.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-phenyltetrazol-5-yl)sulfanylpropan-2-one
Also Known As: 1-[(1-PHENYL-1H-TETRAZOL-5-YL)THIO]ACETONE, AKOS BC-3167, 1-(1-phenyltetrazol-5-yl)sulfanylpropan-2-one, TIMTEC-BB SBB006436, BAS 00731305
| Molecular Formula | C10H10N4OS |
|---|---|
| Molecular Weight | 234.06 g/mol |
| LogP | 1.3434 |
| Topological Polar Surface Area | 60.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 234.05753 |
| Heavy Atoms | 16 |
| Complexity | 482.57407 |
Chemical Identifiers
| CAS Number | 25803-68-3 |
|---|---|
| SMILES | CC(=O)CSC1=NN=NN1C2=CC=CC=C2 |
Product Overview
1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone (CAS 25803-68-3), with molecular formula C10H10N4OS and molecular weight 234.06 g/mol. IUPAC: 1-(1-phenyltetrazol-5-yl)sulfanylpropan-2-one.
Chemical Property Profile of 1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone
Property Insights of 1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone
The XLogP value of 1.3434 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone. The TPSA of 60.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone. Following Lipinski's Rule of Five, 1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone 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-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone?
The CAS number of 1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone is 25803-68-3.
What is the molecular formula of 1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone?
The molecular formula of 1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone is C10H10N4OS.
What is the molecular weight of 1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone?
The molecular weight of 1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone is 234.06 g/mol.
Where can I buy 1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone?
You can request a quote for 1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone?
Yes, KEHONG BIO provides custom synthesis services for 1-[(1-Phenyl-1H-tetrazol-5-YL)thio]acetone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.