BAS 01556303
TL;DR: BAS 01556303 (CAS 1072443-89-0) is a chemical compound with molecular formula C27H29N5OS and molecular weight 471.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-ethyl-6-methylphenyl)-2-[[5-[(4-methylanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 01556303, N-(2-Ethyl-6-methylphenyl)-2-((4-phenyl-5-((p-tolylamino)methyl)-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(2-ethyl-6-methylphenyl)-2-[[5-[(4-methylanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(2-Ethyl-6-methyl-phenyl)-2-[4-phenyl-5-(p-tolylamino-methyl)-4H-[1,2,4]triazol-3-ylsulfanyl]-acetamide, N-(2-ethyl-6-methylphenyl)-2-{[4-phenyl-5-(4-toluidinomethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C27H29N5OS |
|---|---|
| Molecular Weight | 471.21 g/mol |
| LogP | 5.78944 |
| Topological Polar Surface Area | 71.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 471.2093 |
| Heavy Atoms | 34 |
| Complexity | 1252.018 |
Chemical Identifiers
| CAS Number | 1072443-89-0 |
|---|---|
| SMILES | CCC1=CC=CC(=C1NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CNC4=CC=C(C=C4)C)C |
Product Overview
BAS 01556303 (CAS 1072443-89-0), with molecular formula C27H29N5OS and molecular weight 471.21 g/mol. IUPAC: N-(2-ethyl-6-methylphenyl)-2-[[5-[(4-methylanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 01556303
Property Insights of BAS 01556303
The XLogP value of 5.78944 indicates that BAS 01556303 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 01556303. Following Lipinski's Rule of Five, BAS 01556303 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 01556303?
The CAS number of BAS 01556303 is 1072443-89-0.
What is the molecular formula of BAS 01556303?
The molecular formula of BAS 01556303 is C27H29N5OS.
What is the molecular weight of BAS 01556303?
The molecular weight of BAS 01556303 is 471.21 g/mol.
Where can I buy BAS 01556303?
You can request a quote for BAS 01556303 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01556303?
Yes, KEHONG BIO provides custom synthesis services for BAS 01556303 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.