![3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one structure](/static/products/1263/126335-02-2.webp)
3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one
TL;DR: 3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one (CAS 126335-02-2) is a chemical compound with molecular formula C15H18N4OS and molecular weight 302.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one
Also Known As: (Z)-3-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-
| Molecular Formula | C15H18N4OS |
|---|---|
| Molecular Weight | 302.12 g/mol |
| LogP | 3.041 |
| Topological Polar Surface Area | 73.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 302.12012 |
| Heavy Atoms | 21 |
| Complexity | 621.61365 |
Chemical Identifiers
| CAS Number | 126335-02-2 |
|---|---|
| SMILES | CCCCC(=CC(=O)C1=CC=CC=C1)SC2=NN=CN2N |
Product Overview
3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one (CAS 126335-02-2), with molecular formula C15H18N4OS and molecular weight 302.12 g/mol. IUPAC: 3-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one.
Chemical Property Profile of 3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one
Property Insights of 3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one
The XLogP value of 3.041 indicates that 3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one. Following Lipinski's Rule of Five, 3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one has 1 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 3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one?
The CAS number of 3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one is 126335-02-2.
What is the molecular formula of 3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one?
The molecular formula of 3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one is C15H18N4OS.
What is the molecular weight of 3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one?
The molecular weight of 3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one is 302.12 g/mol.
Where can I buy 3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one?
You can request a quote for 3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-Amino-1,2,4-triazol-3-yl)sulfanyl]-1-phenylhept-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.