BAS 01556314
TL;DR: BAS 01556314 (CAS 445249-56-9) is a chemical compound with molecular formula C26H27N5O2S and molecular weight 473.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-ethoxyphenyl)-2-[[5-[(4-methylanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 01556314, N-(4-Ethoxyphenyl)-2-((4-phenyl-5-((p-tolylamino)methyl)-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(4-ethoxyphenyl)-2-[[5-[(4-methylanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(4-Ethoxy-phenyl)-2-[4-phenyl-5-(p-tolylamino-methyl)-4H-[1,2,4]triazol-3-ylsulfanyl]-acetamide, N-(4-ethoxyphenyl)-2-{[4-phenyl-5-(4-toluidinomethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C26H27N5O2S |
|---|---|
| Molecular Weight | 473.19 g/mol |
| LogP | 5.31732 |
| Topological Polar Surface Area | 81.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 473.18854 |
| Heavy Atoms | 34 |
| Complexity | 1208.4418 |
Chemical Identifiers
| CAS Number | 445249-56-9 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CNC4=CC=C(C=C4)C |
Product Overview
BAS 01556314 (CAS 445249-56-9), with molecular formula C26H27N5O2S and molecular weight 473.19 g/mol. IUPAC: N-(4-ethoxyphenyl)-2-[[5-[(4-methylanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 01556314
Property Insights of BAS 01556314
The XLogP value of 5.31732 indicates that BAS 01556314 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.07 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01556314. Following Lipinski's Rule of Five, BAS 01556314 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01556314?
The CAS number of BAS 01556314 is 445249-56-9.
What is the molecular formula of BAS 01556314?
The molecular formula of BAS 01556314 is C26H27N5O2S.
What is the molecular weight of BAS 01556314?
The molecular weight of BAS 01556314 is 473.19 g/mol.
Where can I buy BAS 01556314?
You can request a quote for BAS 01556314 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01556314?
Yes, KEHONG BIO provides custom synthesis services for BAS 01556314 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.