BAS 01918185
TL;DR: BAS 01918185 (CAS 332935-91-8) is a chemical compound with molecular formula C19H19N5OS2 and molecular weight 397.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide
Also Known As: BAS 01918185, 2-((5-Benzyl-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide, 2-(5-Benzyl-4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-acetamide, 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide
| Molecular Formula | C19H19N5OS2 |
|---|---|
| Molecular Weight | 397.10 g/mol |
| LogP | 3.68672 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 397.1031 |
| Heavy Atoms | 27 |
| Complexity | 1001.2743 |
Chemical Identifiers
| CAS Number | 332935-91-8 |
|---|---|
| SMILES | CC1=C(SC(=C1C#N)NC(=O)CSC2=NN=C(N2C)CC3=CC=CC=C3)C |
Product Overview
BAS 01918185 (CAS 332935-91-8), with molecular formula C19H19N5OS2 and molecular weight 397.10 g/mol. IUPAC: 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide.
Chemical Property Profile of BAS 01918185
Property Insights of BAS 01918185
The XLogP value of 3.68672 indicates that BAS 01918185 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01918185. Following Lipinski's Rule of Five, BAS 01918185 has 1 hydrogen bond donor(s) and 6 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 BAS 01918185?
The CAS number of BAS 01918185 is 332935-91-8.
What is the molecular formula of BAS 01918185?
The molecular formula of BAS 01918185 is C19H19N5OS2.
What is the molecular weight of BAS 01918185?
The molecular weight of BAS 01918185 is 397.10 g/mol.
Where can I buy BAS 01918185?
You can request a quote for BAS 01918185 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01918185?
Yes, KEHONG BIO provides custom synthesis services for BAS 01918185 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.