3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide
TL;DR: 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide (CAS 63376-35-2) is a chemical compound with molecular formula C15H12N4O3 and molecular weight 296.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide
Also Known As: 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide, NCI60_032723, 1,2,4-Triazolidine-1-carboxamide,3,5-dioxo-N,4-diphenyl, N,4-Diphenyl-3,5-dioxo-1,2,4-triazolidine-1-carboxamide, 1,2,4-Triazolidine-1-carboxamide, 3,5-dioxo-N,4-diphenyl-
| Molecular Formula | C15H12N4O3 |
|---|---|
| Molecular Weight | 296.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 81.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.09094 |
| Heavy Atoms | 22 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 63376-35-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)N2C(=O)N(C(=O)N2)C3=CC=CC=C3 |
| InChIKey | VYOPQSJWBHYPOC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide (CAS 63376-35-2), with molecular formula C15H12N4O3 and molecular weight 296.09 g/mol. IUPAC: 3,5-dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide.
Chemical Property Profile of 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide
Property Insights of 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide. The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide. Following Lipinski's Rule of Five, 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide has 2 hydrogen bond donor(s) and 3 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 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide?
The CAS number of 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide is 63376-35-2.
What is the molecular formula of 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide?
The molecular formula of 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide is C15H12N4O3.
What is the molecular weight of 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide?
The molecular weight of 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide is 296.09 g/mol.
Where can I buy 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide?
You can request a quote for 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dioxo-N,4-diphenyl-1,2,4-triazolidine-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.