N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide
TL;DR: N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide (CAS 40891-13-2) is a chemical compound with molecular formula C21H17N3O4 and molecular weight 375.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[benzamido-(3-nitrophenyl)methyl]benzamide
Also Known As: N-[benzamido-(3-nitrophenyl)methyl]benzamide, N,N'-(3-nitrobenzylidene)bisbenzamide, N,N'-[(3-nitrophenyl)methanediyl]dibenzamide, BIM-0046504.P001, N,N'-[(3-nitrophenyl)methylene]dibenzamide
| Molecular Formula | C21H17N3O4 |
|---|---|
| Molecular Weight | 375.12 g/mol |
| LogP | 3.4534 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 375.12192 |
| Heavy Atoms | 28 |
| Complexity | 937.3021 |
Chemical Identifiers
| CAS Number | 40891-13-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC(C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC=CC=C3 |
Product Overview
N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide (CAS 40891-13-2), with molecular formula C21H17N3O4 and molecular weight 375.12 g/mol. IUPAC: N-[benzamido-(3-nitrophenyl)methyl]benzamide.
Chemical Property Profile of N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide
Property Insights of N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide
The XLogP value of 3.4534 indicates that N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.34 Ų falls within the moderate polarity range, balancing permeability and solubility for N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide. Following Lipinski's Rule of Five, N-((Benzoylamino)(3-nitrophenyl)methyl)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 N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide?
The CAS number of N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide is 40891-13-2.
What is the molecular formula of N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide?
The molecular formula of N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide is C21H17N3O4.
What is the molecular weight of N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide?
The molecular weight of N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide is 375.12 g/mol.
Where can I buy N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide?
You can request a quote for N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-((Benzoylamino)(3-nitrophenyl)methyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.