N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide
TL;DR: N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide (CAS 304479-40-1) is a chemical compound with molecular formula C18H13N3O5 and molecular weight 351.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide
Also Known As: BAS 00295238, 2-Nitro-benzoic acid [1-(1,3-dioxo-indan-2-yl)-ethylidene]-hydrazide, N'-[1-(1,3-dioxo-2,3-dihydro-1H-inden-2-yl)ethylidene]-2-nitrobenzohydrazide
| Molecular Formula | C18H13N3O5 |
|---|---|
| Molecular Weight | 351.09 g/mol |
| LogP | 2.3959 |
| Topological Polar Surface Area | 118.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 351.0855 |
| Heavy Atoms | 26 |
| Complexity | 945.2968 |
Chemical Identifiers
| CAS Number | 304479-40-1 |
|---|---|
| SMILES | C/C(=N\NC(=O)C1=CC=CC=C1[N+](=O)[O-])/C2C(=O)C3=CC=CC=C3C2=O |
Product Overview
N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide (CAS 304479-40-1), with molecular formula C18H13N3O5 and molecular weight 351.09 g/mol. IUPAC: N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide.
Chemical Property Profile of N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide
Property Insights of N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide
The XLogP value of 2.3959 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide. The TPSA of 118.74 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide. Following Lipinski's Rule of Five, N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide has 1 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 N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide?
The CAS number of N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide is 304479-40-1.
What is the molecular formula of N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide?
The molecular formula of N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide is C18H13N3O5.
What is the molecular weight of N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide?
The molecular weight of N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide is 351.09 g/mol.
Where can I buy N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide?
You can request a quote for N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(E)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-2-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.