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Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate
TL;DR: Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate (CAS 306765-67-3) is a chemical compound with molecular formula C20H19N3O6 and molecular weight 397.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[(Z)-2-benzamido-3-(2-nitrophenyl)prop-2-enoyl]amino]acetate
Also Known As: ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate, (Z)-ethyl 2-(2-benzamido-3-(2-nitrophenyl)acrylamido)acetate, ethyl 2-[[(Z)-2-benzamido-3-(2-nitrophenyl)prop-2-enoyl]amino]acetate
| Molecular Formula | C20H19N3O6 |
|---|---|
| Molecular Weight | 397.13 g/mol |
| LogP | 2.045 |
| Topological Polar Surface Area | 127.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 397.12738 |
| Heavy Atoms | 29 |
| Complexity | 940.24255 |
Chemical Identifiers
| CAS Number | 306765-67-3 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)/C(=C/C1=CC=CC=C1[N+](=O)[O-])/NC(=O)C2=CC=CC=C2 |
Product Overview
Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate (CAS 306765-67-3), with molecular formula C20H19N3O6 and molecular weight 397.13 g/mol. IUPAC: ethyl 2-[[(Z)-2-benzamido-3-(2-nitrophenyl)prop-2-enoyl]amino]acetate.
Chemical Property Profile of Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate
Property Insights of Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate
The XLogP value of 2.045 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate. The TPSA of 127.64 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate. Following Lipinski's Rule of Five, Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate has 2 hydrogen bond donor(s) and 6 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 Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate?
The CAS number of Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate is 306765-67-3.
What is the molecular formula of Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate?
The molecular formula of Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate is C20H19N3O6.
What is the molecular weight of Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate?
The molecular weight of Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate is 397.13 g/mol.
Where can I buy Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate?
You can request a quote for Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl [(2-(benzoylamino)-3-{2-nitrophenyl}acryloyl)amino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.