2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide
TL;DR: 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide (CAS 431072-73-0) is a chemical compound with molecular formula C12H13N3O4 and molecular weight 263.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide
Also Known As: N-methyl-2-(acetamido)-3-(4-nitrophenyl)acrylamide, 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide
| Molecular Formula | C12H13N3O4 |
|---|---|
| Molecular Weight | 263.09 g/mol |
| LogP | 0.8178 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.0906 |
| Heavy Atoms | 19 |
| Complexity | 534.4104 |
Chemical Identifiers
| CAS Number | 431072-73-0 |
|---|---|
| SMILES | CC(=O)NC(=CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)NC |
Product Overview
2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide (CAS 431072-73-0), with molecular formula C12H13N3O4 and molecular weight 263.09 g/mol. IUPAC: 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide.
Chemical Property Profile of 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide
Property Insights of 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide
The XLogP value of 0.8178 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide. The TPSA of 101.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide. Following Lipinski's Rule of Five, 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide has 2 hydrogen bond donor(s) and 4 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-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide?
The CAS number of 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide is 431072-73-0.
What is the molecular formula of 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide?
The molecular formula of 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide is C12H13N3O4.
What is the molecular weight of 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide?
The molecular weight of 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide is 263.09 g/mol.
Where can I buy 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide?
You can request a quote for 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 2-acetamido-N-methyl-3-(4-nitrophenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.