![N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide structure](/static/products/3029/302949-47-9.webp)
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide
TL;DR: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide (CAS 302949-47-9) is a chemical compound with molecular formula C17H16N4O3 and molecular weight 324.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide
Also Known As: BIM-0045458.P001, N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide, N-[2-(1H-1,3-BENZODIAZOL-2-YL)ETHYL]-4-METHYL-3-NITROBENZAMIDE, N-(2-(1H-benzo[d]imidazol-2-yl)ethyl)-4-methyl-3-nitrobenzamide, N-(2-benzimidazol-2-ylethyl)(4-methyl-3-nitrophenyl)carboxamide
| Molecular Formula | C17H16N4O3 |
|---|---|
| Molecular Weight | 324.12 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.12225 |
| Heavy Atoms | 24 |
| Complexity | 467.0 |
Chemical Identifiers
| CAS Number | 302949-47-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NCCC2=NC3=CC=CC=C3N2)[N+](=O)[O-] |
| InChIKey | JPRUSVVGPCANJQ-UHFFFAOYSA-N |
Product Overview
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide (CAS 302949-47-9), with molecular formula C17H16N4O3 and molecular weight 324.12 g/mol. IUPAC: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide.
Chemical Property Profile of N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide
Property Insights of N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide. Following Lipinski's Rule of Five, N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide 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-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide?
The CAS number of N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide is 302949-47-9.
What is the molecular formula of N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide?
The molecular formula of N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide is C17H16N4O3.
What is the molecular weight of N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide?
The molecular weight of N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide is 324.12 g/mol.
Where can I buy N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide?
You can request a quote for N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.