![4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide structure](/static/products/4248/424805-31-2.webp)
4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide
TL;DR: 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide (CAS 424805-31-2) is a chemical compound with molecular formula C17H19N3O3 and molecular weight 313.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-[3-(4-nitroanilino)propyl]benzamide
Also Known As: 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide, BIM-0007861.P001, 4-methyl-N-{3-[(4-nitrophenyl)amino]propyl}benzamide, 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide #, 4-Methyl-N-[3-(4-nitro-phenylamino)-propyl]-benzamide
| Molecular Formula | C17H19N3O3 |
|---|---|
| Molecular Weight | 313.14 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 313.14264 |
| Heavy Atoms | 23 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 424805-31-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NCCCNC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | MXYOAMJEHJWGLU-UHFFFAOYSA-N |
Product Overview
4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide (CAS 424805-31-2), with molecular formula C17H19N3O3 and molecular weight 313.14 g/mol. IUPAC: 4-methyl-N-[3-(4-nitroanilino)propyl]benzamide.
Chemical Property Profile of 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide
Property Insights of 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide
The XLogP value of 4.0 indicates that 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide. Following Lipinski's Rule of Five, 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide has 2 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 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide?
The CAS number of 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide is 424805-31-2.
What is the molecular formula of 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide?
The molecular formula of 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide is C17H19N3O3.
What is the molecular weight of 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide?
The molecular weight of 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide is 313.14 g/mol.
Where can I buy 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide?
You can request a quote for 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-N-[3-(4-nitroanilino)propyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.