propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate
TL;DR: propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate (CAS 5862-04-4) is a chemical compound with molecular formula C19H18N2O5 and molecular weight 354.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate
Also Known As: propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate, BIM-0035601.P001, propyl 2-(benzoylamino)-3-(3-nitrophenyl)acrylate, Propyl (2E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate
| Molecular Formula | C19H18N2O5 |
|---|---|
| Molecular Weight | 354.12 g/mol |
| LogP | 3.3189 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 354.12158 |
| Heavy Atoms | 26 |
| Complexity | 830.83295 |
Chemical Identifiers
| CAS Number | 5862-04-4 |
|---|---|
| SMILES | CCCOC(=O)/C(=C\C1=CC(=CC=C1)[N+](=O)[O-])/NC(=O)C2=CC=CC=C2 |
Product Overview
propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate (CAS 5862-04-4), with molecular formula C19H18N2O5 and molecular weight 354.12 g/mol. IUPAC: propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate.
Chemical Property Profile of propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate
Property Insights of propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate
The XLogP value of 3.3189 indicates that propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.54 Ų falls within the moderate polarity range, balancing permeability and solubility for propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate. Following Lipinski's Rule of Five, propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate has 1 hydrogen bond donor(s) and 5 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 propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate?
The CAS number of propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate is 5862-04-4.
What is the molecular formula of propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate?
The molecular formula of propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate is C19H18N2O5.
What is the molecular weight of propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate?
The molecular weight of propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate is 354.12 g/mol.
Where can I buy propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate?
You can request a quote for propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for propyl (E)-2-benzamido-3-(3-nitrophenyl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.