ASN 05987816
TL;DR: ASN 05987816 (CAS 588712-14-5) is a chemical compound with molecular formula C15H19ClN4OS and molecular weight 338.0968 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-chloro-2-methylphenyl)-2-[(4-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: ASN 05987816, N-(3-chloro-2-methylphenyl)-2-[(4-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide, N-(3-CHLORO-2-METHYLPHENYL)-2-[(5-ISOPROPYL-4-METHYL-4H-1,2,4-TRIAZOL-3-YL)SULFANYL]ACETAMIDE, N-(3-chloro-2-methylphenyl)-2-[4-methyl-5-(methylethyl)(1,2,4-triazol-3-ylthio )]acetamide, N-(3-chloro-2-methylphenyl)-2-{[4-methyl-5-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Technical Specifications
| Molecular Formula | C15H19ClN4OS |
| Molecular Weight | 338.0968 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 85.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 338.0968 Da |
| Heavy Atoms | 22 |
| Complexity | 385.0 |
| SMILES | CC1=C(C=CC=C1Cl)NC(=O)CSC2=NN=C(N2C)C(C)C |
| InChIKey | PNDFIUSYSUDLCB-UHFFFAOYSA-N |
Chemical Property Profile of ASN 05987816
Property Insights of ASN 05987816
The XLogP value of 3.3 indicates that ASN 05987816 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.1 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 05987816. Following Lipinski's Rule of Five, ASN 05987816 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
What is the CAS number of ASN 05987816?
The CAS number of ASN 05987816 is 588712-14-5.
What is the molecular formula of ASN 05987816?
The molecular formula of ASN 05987816 is C15H19ClN4OS.
What is the molecular weight of ASN 05987816?
The molecular weight of ASN 05987816 is 338.0968 g/mol.
Where can I buy ASN 05987816?
You can request a quote for ASN 05987816 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ASN 05987816?
Yes, CoreyChem provides custom synthesis services for ASN 05987816 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.