N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide
TL;DR: N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide (CAS 171506-59-5) is a chemical compound with molecular formula C13H16N2O5 and molecular weight 280.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide
Also Known As: N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide, 4-nitro-N-(4-methoxyphenyl)-5-oxohexanamide, BIM-0041928.P001, 2,6-dioxo-3-nitro-6-(p-methoxyphenylamino)hexane, AH-262/33701014
| Molecular Formula | C13H16N2O5 |
|---|---|
| Molecular Weight | 280.11 g/mol |
| LogP | 1.6482 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 280.10593 |
| Heavy Atoms | 20 |
| Complexity | 483.9879 |
Chemical Identifiers
| CAS Number | 171506-59-5 |
|---|---|
| SMILES | CC(=O)C(CCC(=O)NC1=CC=C(C=C1)OC)[N+](=O)[O-] |
Product Overview
N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide (CAS 171506-59-5), with molecular formula C13H16N2O5 and molecular weight 280.11 g/mol. IUPAC: N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide.
Chemical Property Profile of N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide
Property Insights of N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide
The XLogP value of 1.6482 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide. The TPSA of 98.54 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide. Following Lipinski's Rule of Five, N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide 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-(4-methoxyphenyl)-4-nitro-5-oxohexanamide?
The CAS number of N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide is 171506-59-5.
What is the molecular formula of N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide?
The molecular formula of N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide is C13H16N2O5.
What is the molecular weight of N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide?
The molecular weight of N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide is 280.11 g/mol.
Where can I buy N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide?
You can request a quote for N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-methoxyphenyl)-4-nitro-5-oxohexanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.