BAS 02070137
TL;DR: BAS 02070137 (CAS 335217-95-3) is a chemical compound with molecular formula C25H24ClN5OS and molecular weight 477.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(4-chlorophenyl)-5-[(4-methylanilino)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylphenyl)acetamide
Also Known As: BAS 02070137, 2-((4-(4-Chlorophenyl)-5-((p-tolylamino)methyl)-4H-1,2,4-triazol-3-yl)thio)-N-(m-tolyl)acetamide,
2-[4-(4-Chloro-phenyl)-5-(p-tolylamino-methyl)-4H-[1,2,4]triazol-3-ylsulfan yl]-N-m-tolyl-acetamide, 2-[[4-(4-chlorophenyl)-5-[(4-methylanilino)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylphenyl)acetamide, 2-[4-(4-Chloro-phenyl)-5-(p-tolylamino-methyl)-4H-[1,2,4]triazol-3-ylsulfanyl]-N-m-tolyl-acetamide
| Molecular Formula | C25H24ClN5OS |
|---|---|
| Molecular Weight | 477.14 g/mol |
| LogP | 5.88044 |
| Topological Polar Surface Area | 71.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 477.139 |
| Heavy Atoms | 33 |
| Complexity | 1238.6543 |
Chemical Identifiers
| CAS Number | 335217-95-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NCC2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NC4=CC=CC(=C4)C |
Product Overview
BAS 02070137 (CAS 335217-95-3), with molecular formula C25H24ClN5OS and molecular weight 477.14 g/mol. IUPAC: 2-[[4-(4-chlorophenyl)-5-[(4-methylanilino)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylphenyl)acetamide.
Chemical Property Profile of BAS 02070137
Property Insights of BAS 02070137
The XLogP value of 5.88044 indicates that BAS 02070137 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.84 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02070137. Following Lipinski's Rule of Five, BAS 02070137 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02070137?
The CAS number of BAS 02070137 is 335217-95-3.
What is the molecular formula of BAS 02070137?
The molecular formula of BAS 02070137 is C25H24ClN5OS.
What is the molecular weight of BAS 02070137?
The molecular weight of BAS 02070137 is 477.14 g/mol.
Where can I buy BAS 02070137?
You can request a quote for BAS 02070137 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02070137?
Yes, KEHONG BIO provides custom synthesis services for BAS 02070137 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.