(2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide
TL;DR: (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide (CAS 6100-55-6) is a chemical compound with molecular formula C19H20N2O3 and molecular weight 324.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-benzyl-3-(3-nitrophenyl)-N-propan-2-ylprop-2-enamide
Also Known As: KST-1A6531, BIM-0024522.P001, (2e)-n-benzyl-3-(3-nitrophenyl)-n-(propan-2-yl)prop-2-enamide, (E)-N-benzyl-3-(3-nitrophenyl)-N-propan-2-ylprop-2-enamide, (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide
| Molecular Formula | C19H20N2O3 |
|---|---|
| Molecular Weight | 324.15 g/mol |
| LogP | 4.0452 |
| Topological Polar Surface Area | 63.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 324.1474 |
| Heavy Atoms | 24 |
| Complexity | 739.2869 |
Chemical Identifiers
| CAS Number | 6100-55-6 |
|---|---|
| SMILES | CC(C)N(CC1=CC=CC=C1)C(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-] |
Product Overview
(2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide (CAS 6100-55-6), with molecular formula C19H20N2O3 and molecular weight 324.15 g/mol. IUPAC: (E)-N-benzyl-3-(3-nitrophenyl)-N-propan-2-ylprop-2-enamide.
Chemical Property Profile of (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide
Property Insights of (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide
The XLogP value of 4.0452 indicates that (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.45 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide. Following Lipinski's Rule of Five, (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide has 0 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 (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide?
The CAS number of (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide is 6100-55-6.
What is the molecular formula of (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide?
The molecular formula of (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide is C19H20N2O3.
What is the molecular weight of (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide?
The molecular weight of (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide is 324.15 g/mol.
Where can I buy (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide?
You can request a quote for (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-N-(methylethyl)-3-(3-nitrophenyl)-N-benzylprop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.