2-methyl-N,N'-diphenylbut-2-enediamide
TL;DR: 2-methyl-N,N'-diphenylbut-2-enediamide (CAS 6317-74-4) is a chemical compound with molecular formula C17H16N2O2 and molecular weight 280.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N,N'-diphenylbut-2-enediamide
Also Known As: Mesaconanilide, 2-methyl-N,N'-diphenylbut-2-enediamide
| Molecular Formula | C17H16N2O2 |
|---|---|
| Molecular Weight | 280.12 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.1212 |
| Heavy Atoms | 21 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 6317-74-4 |
|---|---|
| SMILES | CC(=CC(=O)NC1=CC=CC=C1)C(=O)NC2=CC=CC=C2 |
| InChIKey | NEPXZCHAXZPTTC-UHFFFAOYSA-N |
Product Overview
2-methyl-N,N'-diphenylbut-2-enediamide (CAS 6317-74-4), with molecular formula C17H16N2O2 and molecular weight 280.12 g/mol. IUPAC: 2-methyl-N,N'-diphenylbut-2-enediamide.
Chemical Property Profile of 2-methyl-N,N'-diphenylbut-2-enediamide
Property Insights of 2-methyl-N,N'-diphenylbut-2-enediamide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-N,N'-diphenylbut-2-enediamide. With a topological polar surface area (TPSA) of 58.2 Ų, 2-methyl-N,N'-diphenylbut-2-enediamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-methyl-N,N'-diphenylbut-2-enediamide has 2 hydrogen bond donor(s) and 2 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 2-methyl-N,N'-diphenylbut-2-enediamide?
The CAS number of 2-methyl-N,N'-diphenylbut-2-enediamide is 6317-74-4.
What is the molecular formula of 2-methyl-N,N'-diphenylbut-2-enediamide?
The molecular formula of 2-methyl-N,N'-diphenylbut-2-enediamide is C17H16N2O2.
What is the molecular weight of 2-methyl-N,N'-diphenylbut-2-enediamide?
The molecular weight of 2-methyl-N,N'-diphenylbut-2-enediamide is 280.12 g/mol.
Where can I buy 2-methyl-N,N'-diphenylbut-2-enediamide?
You can request a quote for 2-methyl-N,N'-diphenylbut-2-enediamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-N,N'-diphenylbut-2-enediamide?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-N,N'-diphenylbut-2-enediamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.