1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole
TL;DR: 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole (CAS 391229-97-3) is a chemical compound with molecular formula C15H18N4O2 and molecular weight 286.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-2-methyl-4-nitro-5-pyrrolidin-1-ylimidazole
Also Known As: F0230-0045, 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole, 1-benzyl-2-methyl-4-nitro-5-pyrrolidin-1-ylimidazole, 1-benzyl-2-methyl-4-nitro-5-(1-pyrrolidinyl)imidazole
| Molecular Formula | C15H18N4O2 |
|---|---|
| Molecular Weight | 286.14 g/mol |
| LogP | 2.74822 |
| Topological Polar Surface Area | 64.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.14297 |
| Heavy Atoms | 21 |
| Complexity | 645.1933 |
Chemical Identifiers
| CAS Number | 391229-97-3 |
|---|---|
| SMILES | CC1=NC(=C(N1CC2=CC=CC=C2)N3CCCC3)[N+](=O)[O-] |
Product Overview
1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole (CAS 391229-97-3), with molecular formula C15H18N4O2 and molecular weight 286.14 g/mol. IUPAC: 1-benzyl-2-methyl-4-nitro-5-pyrrolidin-1-ylimidazole.
Chemical Property Profile of 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole
Property Insights of 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole
The XLogP value of 2.74822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole. The TPSA of 64.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole. Following Lipinski's Rule of Five, 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole has 0 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 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole?
The CAS number of 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole is 391229-97-3.
What is the molecular formula of 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole?
The molecular formula of 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole is C15H18N4O2.
What is the molecular weight of 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole?
The molecular weight of 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole is 286.14 g/mol.
Where can I buy 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole?
You can request a quote for 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-benzyl-2-methyl-4-nitro-5-(pyrrolidin-1-yl)-1H-imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.