Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide
TL;DR: Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide (CAS 330987-69-4) is a chemical compound with molecular formula C17H15N3O3 and molecular weight 309.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[(E)-3-(3-nitrophenyl)prop-2-enylidene]amino]-2-phenylacetamide
Also Known As: BAS 00493288, Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide, (E)-N'-((E)-3-(3-nitrophenyl)allylidene)-2-phenylacetohydrazide, N'-[(1E,2E)-3-(3-nitrophenyl)prop-2-en-1-ylidene]-2-phenylacetohydrazide, N-[(1E,3E)-4-(3-nitrophenyl)-1-azabuta-1,3-dienyl]-2-phenylacetamide
| Molecular Formula | C17H15N3O3 |
|---|---|
| Molecular Weight | 309.11 g/mol |
| LogP | 2.9527 |
| Topological Polar Surface Area | 84.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 309.11133 |
| Heavy Atoms | 23 |
| Complexity | 739.7586 |
Chemical Identifiers
| CAS Number | 330987-69-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(=O)N/N=C/C=C/C2=CC(=CC=C2)[N+](=O)[O-] |
Product Overview
Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide (CAS 330987-69-4), with molecular formula C17H15N3O3 and molecular weight 309.11 g/mol. IUPAC: N-[(E)-[(E)-3-(3-nitrophenyl)prop-2-enylidene]amino]-2-phenylacetamide.
Chemical Property Profile of Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide
Property Insights of Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide
The XLogP value of 2.9527 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide. The TPSA of 84.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide. Following Lipinski's Rule of Five, Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide has 1 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 Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide?
The CAS number of Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide is 330987-69-4.
What is the molecular formula of Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide?
The molecular formula of Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide is C17H15N3O3.
What is the molecular weight of Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide?
The molecular weight of Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide is 309.11 g/mol.
Where can I buy Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide?
You can request a quote for Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide?
Yes, KEHONG BIO provides custom synthesis services for Phenyl-acetic acid [3-(3-nitro-phenyl)-allylidene]-hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.