AB00121529-01
TL;DR: AB00121529-01 (CAS 433233-44-4) is a chemical compound with molecular formula C20H14Cl2N4OS2 and molecular weight 460.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-dichlorophenyl)-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: AB00121529-01, N-(3,4-dichlorophenyl)-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide, N-(3,4-dichlorophenyl)-2-{[4-phenyl-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(3,4-dichlorophenyl)-2-((4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(3,4-dichlorophenyl)-2-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C20H14Cl2N4OS2 |
|---|---|
| Molecular Weight | 460.00 g/mol |
| LogP | 6.0334 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 459.9986 |
| Heavy Atoms | 29 |
| Complexity | 1130.861 |
Chemical Identifiers
| CAS Number | 433233-44-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC(=C(C=C3)Cl)Cl)C4=CC=CS4 |
Product Overview
AB00121529-01 (CAS 433233-44-4), with molecular formula C20H14Cl2N4OS2 and molecular weight 460.00 g/mol. IUPAC: N-(3,4-dichlorophenyl)-2-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of AB00121529-01
Property Insights of AB00121529-01
The XLogP value of 6.0334 indicates that AB00121529-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, AB00121529-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00121529-01 has 1 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 AB00121529-01?
The CAS number of AB00121529-01 is 433233-44-4.
What is the molecular formula of AB00121529-01?
The molecular formula of AB00121529-01 is C20H14Cl2N4OS2.
What is the molecular weight of AB00121529-01?
The molecular weight of AB00121529-01 is 460.00 g/mol.
Where can I buy AB00121529-01?
You can request a quote for AB00121529-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00121529-01?
Yes, KEHONG BIO provides custom synthesis services for AB00121529-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.