N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide
TL;DR: N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide (CAS 58624-62-7) is a chemical compound with molecular formula C15H11N5O5 and molecular weight 341.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide
Also Known As: N-(1H-benzoimidazol-2-ylmethyl)-3,5-dinitro-benzamide, N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide, VU0604965-1, F3225-5879, N-((1H-benzo[d]imidazol-2-yl)methyl)-3,5-dinitrobenzamide
| Molecular Formula | C15H11N5O5 |
|---|---|
| Molecular Weight | 341.08 g/mol |
| LogP | 2.3093 |
| Topological Polar Surface Area | 144.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 341.07602 |
| Heavy Atoms | 25 |
| Complexity | 931.6457 |
Chemical Identifiers
| CAS Number | 58624-62-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)CNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide (CAS 58624-62-7), with molecular formula C15H11N5O5 and molecular weight 341.08 g/mol. IUPAC: N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide.
Chemical Property Profile of N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide
Property Insights of N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide
The XLogP value of 2.3093 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide. The TPSA of 144.06 Ų indicates high polarity, suggesting N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide has 2 hydrogen bond donor(s) and 6 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-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide?
The CAS number of N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide is 58624-62-7.
What is the molecular formula of N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide?
The molecular formula of N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide is C15H11N5O5.
What is the molecular weight of N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide?
The molecular weight of N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide is 341.08 g/mol.
Where can I buy N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide?
You can request a quote for N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1H-benzimidazol-2-ylmethyl)-3,5-dinitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.