AB00727151-01
TL;DR: AB00727151-01 (CAS 578698-73-4) is a chemical compound with molecular formula C23H21N5O2S and molecular weight 431.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-amino-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylphenyl)acetamide
Also Known As: AB00727151-01, 2-[4-amino-5-(4-methoxyphenyl)(1,2,4-triazol-3-ylthio)]-N-(2-phenylphenyl)acet amide, 2-[[4-amino-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylphenyl)acetamide, 2-{[4-amino-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(biphenyl-2-yl)acetamide, N-([1,1'-biphenyl]-2-yl)-2-((4-amino-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)acetamide
| Molecular Formula | C23H21N5O2S |
|---|---|
| Molecular Weight | 431.14 g/mol |
| LogP | 4.0653 |
| Topological Polar Surface Area | 95.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 431.1416 |
| Heavy Atoms | 31 |
| Complexity | 1176.3134 |
Chemical Identifiers
| CAS Number | 578698-73-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN=C(N2N)SCC(=O)NC3=CC=CC=C3C4=CC=CC=C4 |
Product Overview
AB00727151-01 (CAS 578698-73-4), with molecular formula C23H21N5O2S and molecular weight 431.14 g/mol. IUPAC: 2-[[4-amino-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylphenyl)acetamide.
Chemical Property Profile of AB00727151-01
Property Insights of AB00727151-01
The XLogP value of 4.0653 indicates that AB00727151-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.06 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00727151-01. Following Lipinski's Rule of Five, AB00727151-01 has 2 hydrogen bond donor(s) and 6 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 AB00727151-01?
The CAS number of AB00727151-01 is 578698-73-4.
What is the molecular formula of AB00727151-01?
The molecular formula of AB00727151-01 is C23H21N5O2S.
What is the molecular weight of AB00727151-01?
The molecular weight of AB00727151-01 is 431.14 g/mol.
Where can I buy AB00727151-01?
You can request a quote for AB00727151-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00727151-01?
Yes, KEHONG BIO provides custom synthesis services for AB00727151-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.