BAS 02069892
TL;DR: BAS 02069892 (CAS 335217-61-3) is a chemical compound with molecular formula C23H21N5OS and molecular weight 415.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dimethylphenyl)-2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: BAS 02069892, N-(2,4-dimethylphenyl)-2-(4-phenyl-5-(3-pyridyl)(1,2,4-triazol-3-ylthio))aceta mide, N-(2,4-dimethylphenyl)-2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide, N-(2,4-dimethylphenyl)-2-((4-phenyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(2,4-dimethylphenyl)-2-{[4-phenyl-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C23H21N5OS |
|---|---|
| Molecular Weight | 415.15 g/mol |
| LogP | 4.67694 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 415.14667 |
| Heavy Atoms | 30 |
| Complexity | 1158.9492 |
Chemical Identifiers
| CAS Number | 335217-61-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CN=CC=C4)C |
Product Overview
BAS 02069892 (CAS 335217-61-3), with molecular formula C23H21N5OS and molecular weight 415.15 g/mol. IUPAC: N-(2,4-dimethylphenyl)-2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of BAS 02069892
Property Insights of BAS 02069892
The XLogP value of 4.67694 indicates that BAS 02069892 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02069892. Following Lipinski's Rule of Five, BAS 02069892 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 BAS 02069892?
The CAS number of BAS 02069892 is 335217-61-3.
What is the molecular formula of BAS 02069892?
The molecular formula of BAS 02069892 is C23H21N5OS.
What is the molecular weight of BAS 02069892?
The molecular weight of BAS 02069892 is 415.15 g/mol.
Where can I buy BAS 02069892?
You can request a quote for BAS 02069892 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02069892?
Yes, KEHONG BIO provides custom synthesis services for BAS 02069892 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.