N-(3-ethoxypropyl)-4-nitrobenzamide
TL;DR: N-(3-ethoxypropyl)-4-nitrobenzamide (CAS 690967-19-2) is a chemical compound with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-ethoxypropyl)-4-nitrobenzamide
Also Known As: N-(3-ethoxypropyl)-4-nitrobenzamide, N-(3-Ethoxy-propyl)-4-nitro-benzamide, N-(3-ethoxypropyl)(4-nitrophenyl)carboxamide
| Molecular Formula | C12H16N2O4 |
|---|---|
| Molecular Weight | 252.11 g/mol |
| LogP | 1.7512 |
| Topological Polar Surface Area | 81.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 252.11101 |
| Heavy Atoms | 18 |
| Complexity | 403.04337 |
Chemical Identifiers
| CAS Number | 690967-19-2 |
|---|---|
| SMILES | CCOCCCNC(=O)C1=CC=C(C=C1)[N+](=O)[O-] |
Product Overview
N-(3-ethoxypropyl)-4-nitrobenzamide (CAS 690967-19-2), with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol. IUPAC: N-(3-ethoxypropyl)-4-nitrobenzamide.
Chemical Property Profile of N-(3-ethoxypropyl)-4-nitrobenzamide
Property Insights of N-(3-ethoxypropyl)-4-nitrobenzamide
The XLogP value of 1.7512 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-ethoxypropyl)-4-nitrobenzamide. The TPSA of 81.47 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-ethoxypropyl)-4-nitrobenzamide. Following Lipinski's Rule of Five, N-(3-ethoxypropyl)-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-(3-ethoxypropyl)-4-nitrobenzamide?
The CAS number of N-(3-ethoxypropyl)-4-nitrobenzamide is 690967-19-2.
What is the molecular formula of N-(3-ethoxypropyl)-4-nitrobenzamide?
The molecular formula of N-(3-ethoxypropyl)-4-nitrobenzamide is C12H16N2O4.
What is the molecular weight of N-(3-ethoxypropyl)-4-nitrobenzamide?
The molecular weight of N-(3-ethoxypropyl)-4-nitrobenzamide is 252.11 g/mol.
Where can I buy N-(3-ethoxypropyl)-4-nitrobenzamide?
You can request a quote for N-(3-ethoxypropyl)-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-(3-ethoxypropyl)-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-ethoxypropyl)-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.