1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide
TL;DR: 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide (CAS 345616-71-9) is a chemical compound with molecular formula C11H9N5O5 and molecular weight 291.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-5-nitro-N-(3-nitrophenyl)imidazole-4-carboxamide
Also Known As: 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide, 3-methyl-5-nitro-N-(3-nitrophenyl)imidazole-4-carboxamide, AF-399/33326049, F0365-0028, 4-nitro-N-{3-nitrophenyl}-1-methyl-1H-imidazole-5-carboxamide
| Molecular Formula | C11H9N5O5 |
|---|---|
| Molecular Weight | 291.06 g/mol |
| LogP | 1.4888 |
| Topological Polar Surface Area | 133.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.06036 |
| Heavy Atoms | 21 |
| Complexity | 738.3552 |
Chemical Identifiers
| CAS Number | 345616-71-9 |
|---|---|
| SMILES | CN1C=NC(=C1C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide (CAS 345616-71-9), with molecular formula C11H9N5O5 and molecular weight 291.06 g/mol. IUPAC: 3-methyl-5-nitro-N-(3-nitrophenyl)imidazole-4-carboxamide.
Chemical Property Profile of 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide
Property Insights of 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide
The XLogP value of 1.4888 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide. The TPSA of 133.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide. Following Lipinski's Rule of Five, 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide has 1 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 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide?
The CAS number of 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide is 345616-71-9.
What is the molecular formula of 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide?
The molecular formula of 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide is C11H9N5O5.
What is the molecular weight of 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide?
The molecular weight of 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide is 291.06 g/mol.
Where can I buy 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide?
You can request a quote for 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-methyl-4-nitro-N-(3-nitrophenyl)-1H-imidazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.