BAS 02137358
TL;DR: BAS 02137358 (CAS 482646-01-5) is a chemical compound with molecular formula C22H26ClN5OS and molecular weight 443.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-chloro-2-methylphenyl)-2-[[5-[(2,4-dimethylanilino)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 02137358, N-(5-chloro-2-methylphenyl)-2-({5-[(2,4-dimethylanilino)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide, N-(5-chloro-2-methylphenyl)-2-[[5-[(2,4-dimethylanilino)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C22H26ClN5OS |
|---|---|
| Molecular Weight | 443.15 g/mol |
| LogP | 5.21956 |
| Topological Polar Surface Area | 71.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 443.15466 |
| Heavy Atoms | 30 |
| Complexity | 1050.0023 |
Chemical Identifiers
| CAS Number | 482646-01-5 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)Cl)C)CNC3=C(C=C(C=C3)C)C |
Product Overview
BAS 02137358 (CAS 482646-01-5), with molecular formula C22H26ClN5OS and molecular weight 443.15 g/mol. IUPAC: N-(5-chloro-2-methylphenyl)-2-[[5-[(2,4-dimethylanilino)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 02137358
Property Insights of BAS 02137358
The XLogP value of 5.21956 indicates that BAS 02137358 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 02137358. Following Lipinski's Rule of Five, BAS 02137358 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 02137358?
The CAS number of BAS 02137358 is 482646-01-5.
What is the molecular formula of BAS 02137358?
The molecular formula of BAS 02137358 is C22H26ClN5OS.
What is the molecular weight of BAS 02137358?
The molecular weight of BAS 02137358 is 443.15 g/mol.
Where can I buy BAS 02137358?
You can request a quote for BAS 02137358 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02137358?
Yes, KEHONG BIO provides custom synthesis services for BAS 02137358 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.