N-(2-ethylbutylideneamino)-4-nitrobenzamide
TL;DR: N-(2-ethylbutylideneamino)-4-nitrobenzamide (CAS 2447-76-9) is a chemical compound with molecular formula C13H17N3O3 and molecular weight 263.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-ethylbutylideneamino)-4-nitrobenzamide
Also Known As: N-(2-ethylbutylideneamino)-4-nitrobenzamide, N'-(2-ethylbutylidene)-4-nitrobenzohydrazide, Benzoic acid, 4-nitro-,2-(2-ethylbutylidene)hydrazide
| Molecular Formula | C13H17N3O3 |
|---|---|
| Molecular Weight | 263.13 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 87.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 263.12698 |
| Heavy Atoms | 19 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 2447-76-9 |
|---|---|
| SMILES | CCC(CC)C=NNC(=O)C1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | VSKNYMJHMKXCLE-UHFFFAOYSA-N |
Product Overview
N-(2-ethylbutylideneamino)-4-nitrobenzamide (CAS 2447-76-9), with molecular formula C13H17N3O3 and molecular weight 263.13 g/mol. IUPAC: N-(2-ethylbutylideneamino)-4-nitrobenzamide.
Chemical Property Profile of N-(2-ethylbutylideneamino)-4-nitrobenzamide
Property Insights of N-(2-ethylbutylideneamino)-4-nitrobenzamide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-ethylbutylideneamino)-4-nitrobenzamide. The TPSA of 87.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-ethylbutylideneamino)-4-nitrobenzamide. Following Lipinski's Rule of Five, N-(2-ethylbutylideneamino)-4-nitrobenzamide 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 N-(2-ethylbutylideneamino)-4-nitrobenzamide?
The CAS number of N-(2-ethylbutylideneamino)-4-nitrobenzamide is 2447-76-9.
What is the molecular formula of N-(2-ethylbutylideneamino)-4-nitrobenzamide?
The molecular formula of N-(2-ethylbutylideneamino)-4-nitrobenzamide is C13H17N3O3.
What is the molecular weight of N-(2-ethylbutylideneamino)-4-nitrobenzamide?
The molecular weight of N-(2-ethylbutylideneamino)-4-nitrobenzamide is 263.13 g/mol.
Where can I buy N-(2-ethylbutylideneamino)-4-nitrobenzamide?
You can request a quote for N-(2-ethylbutylideneamino)-4-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-ethylbutylideneamino)-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-ethylbutylideneamino)-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.