C15H19ClN4OS
TL;DR: C15H19ClN4OS (CAS 892221-49-7) is a chemical compound with molecular formula C15H19ClN4OS and molecular weight 338.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenyl)-4-(3-morpholin-4-ylpropyl)-1H-1,2,4-triazole-5-thione
Also Known As: 5-(2-chlorophenyl)-4-(3-morpholinopropyl)-4H-1,2,4-triazole-3-thiol, 3-(2-chlorophenyl)-4-(3-morpholin-4-ylpropyl)-1H-1,2,4-triazole-5-thione, 5-(2-chlorophenyl)-4-(3-morpholin-4-ylpropyl)-2H-1,2,4-triazole-3-thione, 5-(2-chlorophenyl)-4-[3-(morpholin-4-yl)propyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione, 3-(2-CHLOROPHENYL)-4-[3-(MORPHOLIN-4-YL)PROPYL]-4,5-DIHYDRO-1H-1,2,4-TRIAZOLE-5-THIONE
| Molecular Formula | C15H19ClN4OS |
|---|---|
| Molecular Weight | 338.10 g/mol |
| LogP | 2.98339 |
| Topological Polar Surface Area | 46.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 338.0968 |
| Heavy Atoms | 22 |
| Complexity | 678.1771 |
Chemical Identifiers
| CAS Number | 892221-49-7 |
|---|---|
| SMILES | C1COCCN1CCCN2C(=NNC2=S)C3=CC=CC=C3Cl |
Product Overview
C15H19ClN4OS (CAS 892221-49-7), with molecular formula C15H19ClN4OS and molecular weight 338.10 g/mol. IUPAC: 3-(2-chlorophenyl)-4-(3-morpholin-4-ylpropyl)-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of C15H19ClN4OS
Property Insights of C15H19ClN4OS
The XLogP value of 2.98339 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C15H19ClN4OS. With a topological polar surface area (TPSA) of 46.08 Ų, C15H19ClN4OS exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C15H19ClN4OS has 1 hydrogen bond donor(s) and 4 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 C15H19ClN4OS?
The CAS number of C15H19ClN4OS is 892221-49-7.
What is the molecular formula of C15H19ClN4OS?
The molecular formula of C15H19ClN4OS is C15H19ClN4OS.
What is the molecular weight of C15H19ClN4OS?
The molecular weight of C15H19ClN4OS is 338.10 g/mol.
Where can I buy C15H19ClN4OS?
You can request a quote for C15H19ClN4OS directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C15H19ClN4OS?
Yes, KEHONG BIO provides custom synthesis services for C15H19ClN4OS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.