BAS 02071302
TL;DR: BAS 02071302 (CAS 482639-70-3) is a chemical compound with molecular formula C18H18BrN5OS and molecular weight 431.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-bromo-4-methylphenyl)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: BAS 02071302, N-(2-bromo-4-methylphenyl)-2-{[4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(2-Bromo-4-methylphenyl)-2-((4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(2-BROMO-4-METHYLPHENYL)-2-{[4-ETHYL-5-(4-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE, N-(2-bromo-4-methylphenyl)-2-(4-ethyl-5-(4-pyridyl)(1,2,4-triazol-3-ylthio))ac etamide
| Molecular Formula | C18H18BrN5OS |
|---|---|
| Molecular Weight | 431.04 g/mol |
| LogP | 4.16172 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.04153 |
| Heavy Atoms | 26 |
| Complexity | 913.1998 |
Chemical Identifiers
| CAS Number | 482639-70-3 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)C)Br)C3=CC=NC=C3 |
Product Overview
BAS 02071302 (CAS 482639-70-3), with molecular formula C18H18BrN5OS and molecular weight 431.04 g/mol. IUPAC: N-(2-bromo-4-methylphenyl)-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of BAS 02071302
Property Insights of BAS 02071302
The XLogP value of 4.16172 indicates that BAS 02071302 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 02071302. Following Lipinski's Rule of Five, BAS 02071302 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 02071302?
The CAS number of BAS 02071302 is 482639-70-3.
What is the molecular formula of BAS 02071302?
The molecular formula of BAS 02071302 is C18H18BrN5OS.
What is the molecular weight of BAS 02071302?
The molecular weight of BAS 02071302 is 431.04 g/mol.
Where can I buy BAS 02071302?
You can request a quote for BAS 02071302 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02071302?
Yes, KEHONG BIO provides custom synthesis services for BAS 02071302 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.