AB00711448-01
TL;DR: AB00711448-01 (CAS 380458-00-4) is a chemical compound with molecular formula C18H17ClN4O2S and molecular weight 388.07608 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-chlorophenyl)-4-[(E)-(4-ethoxy-3-methoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione
Also Known As: AB00711448-01, (E)-5-(4-chlorophenyl)-4-((4-ethoxy-3-methoxybenzylidene)amino)-4H-1,2,4-triazole-3-thiol, 3-(4-chlorophenyl)-4-[(E)-(4-ethoxy-3-methoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione, 5-(4-CL-PH)-4-((4-ETHOXY-3-METHOXYBENZYLIDENE)AMINO)-4H-1,2,4-TRIAZOLE-3-THIOL, 4-[(1E)-2-(4-ethoxy-3-methoxyphenyl)-1-azavinyl]-5-(4-chlorophenyl)-1,2,4-tria zole-3-thiol
Technical Specifications
| Molecular Formula | C18H17ClN4O2S |
| Molecular Weight | 388.07608 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 90.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 388.07608 Da |
| Heavy Atoms | 26 |
| Complexity | 551.0 |
| SMILES | CCOC1=C(C=C(C=C1)/C=N/N2C(=NNC2=S)C3=CC=C(C=C3)Cl)OC |
| InChIKey | JPZRNLINTYKGFZ-RGVLZGJSSA-N |
Chemical Property Profile of AB00711448-01
Property Insights of AB00711448-01
The XLogP value of 4.2 indicates that AB00711448-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.5 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00711448-01. Following Lipinski's Rule of Five, AB00711448-01 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of AB00711448-01?
The CAS number of AB00711448-01 is 380458-00-4.
What is the molecular formula of AB00711448-01?
The molecular formula of AB00711448-01 is C18H17ClN4O2S.
What is the molecular weight of AB00711448-01?
The molecular weight of AB00711448-01 is 388.07608 g/mol.
Where can I buy AB00711448-01?
You can request a quote for AB00711448-01 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for AB00711448-01?
Yes, CoreyChem provides custom synthesis services for AB00711448-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.