2-methyl-3-nitro-N-(1-phenylpropyl)benzamide
TL;DR: 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide (CAS 445000-17-9) is a chemical compound with molecular formula C17H18N2O3 and molecular weight 298.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-nitro-N-(1-phenylpropyl)benzamide
Also Known As: 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide, 3-nitro-2-methyl-N-(1-phenylpropyl)benzamide, (2-methyl-3-nitrophenyl)-N-(phenylpropyl)carboxamide, 2-METHYL-3-NITRO-N~1~-(1-PHENYLPROPYL)BENZAMIDE
| Molecular Formula | C17H18N2O3 |
|---|---|
| Molecular Weight | 298.13 g/mol |
| LogP | 3.78432 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 298.13174 |
| Heavy Atoms | 22 |
| Complexity | 683.55835 |
Chemical Identifiers
| CAS Number | 445000-17-9 |
|---|---|
| SMILES | CCC(C1=CC=CC=C1)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C |
Product Overview
2-methyl-3-nitro-N-(1-phenylpropyl)benzamide (CAS 445000-17-9), with molecular formula C17H18N2O3 and molecular weight 298.13 g/mol. IUPAC: 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide.
Chemical Property Profile of 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide
Property Insights of 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide
The XLogP value of 3.78432 indicates that 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide. Following Lipinski's Rule of Five, 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide has 1 hydrogen bond donor(s) and 3 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 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide?
The CAS number of 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide is 445000-17-9.
What is the molecular formula of 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide?
The molecular formula of 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide is C17H18N2O3.
What is the molecular weight of 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide?
The molecular weight of 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide is 298.13 g/mol.
Where can I buy 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide?
You can request a quote for 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-3-nitro-N-(1-phenylpropyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.