A2124/0089164
TL;DR: A2124/0089164 (CAS 309277-57-4) is a chemical compound with molecular formula C18H12N4O3S and molecular weight 364.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6Z)-3-(4-methylphenyl)-6-[(4-nitrophenyl)methylidene]-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one
Also Known As: A2124/0089164, (6Z)-3-(4-methylphenyl)-6-[(4-nitrophenyl)methylidene]-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one, (Z)-6-(4-nitrobenzylidene)-3-(p-tolyl)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one, 6-{4-nitrobenzylidene}-3-(4-methylphenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one, (6Z)-3-(4-methylphenyl)-6-(4-nitrobenzylidene)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one
| Molecular Formula | C18H12N4O3S |
|---|---|
| Molecular Weight | 364.06 g/mol |
| LogP | 2.58232 |
| Topological Polar Surface Area | 90.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 364.06302 |
| Heavy Atoms | 26 |
| Complexity | 1224.6663 |
Chemical Identifiers
| CAS Number | 309277-57-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN=C3N2C(=O)/C(=C/C4=CC=C(C=C4)[N+](=O)[O-])/S3 |
Product Overview
A2124/0089164 (CAS 309277-57-4), with molecular formula C18H12N4O3S and molecular weight 364.06 g/mol. IUPAC: (6Z)-3-(4-methylphenyl)-6-[(4-nitrophenyl)methylidene]-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one.
Chemical Property Profile of A2124/0089164
Property Insights of A2124/0089164
The XLogP value of 2.58232 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2124/0089164. The TPSA of 90.4 Ų falls within the moderate polarity range, balancing permeability and solubility for A2124/0089164. Following Lipinski's Rule of Five, A2124/0089164 has 0 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 A2124/0089164?
The CAS number of A2124/0089164 is 309277-57-4.
What is the molecular formula of A2124/0089164?
The molecular formula of A2124/0089164 is C18H12N4O3S.
What is the molecular weight of A2124/0089164?
The molecular weight of A2124/0089164 is 364.06 g/mol.
Where can I buy A2124/0089164?
You can request a quote for A2124/0089164 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2124/0089164?
Yes, KEHONG BIO provides custom synthesis services for A2124/0089164 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.