N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide
TL;DR: N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide (CAS 884342-49-8) is a chemical compound with molecular formula C12H12N2O5 and molecular weight 264.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(cyclopropylcarbamoyl)-5-nitrobenzoate
Also Known As: N-Cyclopropyl 3-methoxycarbonyl-5-nitrobenzamide, methyl 3-(cyclopropylcarbamoyl)-5-nitrobenzoate, N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide
| Molecular Formula | C12H12N2O5 |
|---|---|
| Molecular Weight | 264.07 g/mol |
| LogP | 1.2736 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.07462 |
| Heavy Atoms | 19 |
| Complexity | 551.0508 |
Chemical Identifiers
| CAS Number | 884342-49-8 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC(=C1)C(=O)NC2CC2)[N+](=O)[O-] |
Product Overview
N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide (CAS 884342-49-8), with molecular formula C12H12N2O5 and molecular weight 264.07 g/mol. IUPAC: methyl 3-(cyclopropylcarbamoyl)-5-nitrobenzoate.
Chemical Property Profile of N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide
Property Insights of N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide
The XLogP value of 1.2736 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide. The TPSA of 98.54 Ų falls within the moderate polarity range, balancing permeability and solubility for N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide. Following Lipinski's Rule of Five, N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide has 1 hydrogen bond donor(s) and 5 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-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide?
The CAS number of N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide is 884342-49-8.
What is the molecular formula of N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide?
The molecular formula of N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide is C12H12N2O5.
What is the molecular weight of N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide?
The molecular weight of N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide is 264.07 g/mol.
Where can I buy N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide?
You can request a quote for N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-cyclopropyl-3-methoxycarbonyl-5-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.