5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide
TL;DR: 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide (CAS 447449-49-2) is a chemical compound with molecular formula C13H16N4O and molecular weight 244.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-2-methyl-1-(2-phenylethyl)imidazole-4-carboxamide
Also Known As: ZERO/005428, 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide, 5-amino-2-methyl-1-phenethyl-1H-imidazole-4-carboxamide, 5-amino-2-methyl-1-(2-phenylethyl)imidazole-4-carboxamide, 5-amino-2-methyl-1-phenethylimidazole-4-carboxamide
| Molecular Formula | C13H16N4O |
|---|---|
| Molecular Weight | 244.13 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 86.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.13242 |
| Heavy Atoms | 18 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 447449-49-2 |
|---|---|
| SMILES | CC1=NC(=C(N1CCC2=CC=CC=C2)N)C(=O)N |
| InChIKey | KDRSIJXVHXRFDW-UHFFFAOYSA-N |
Product Overview
5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide (CAS 447449-49-2), with molecular formula C13H16N4O and molecular weight 244.13 g/mol. IUPAC: 5-amino-2-methyl-1-(2-phenylethyl)imidazole-4-carboxamide.
Chemical Property Profile of 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide
Property Insights of 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide. The TPSA of 86.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide. Following Lipinski's Rule of Five, 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide has 2 hydrogen bond donor(s) and 3 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 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide?
The CAS number of 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide is 447449-49-2.
What is the molecular formula of 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide?
The molecular formula of 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide is C13H16N4O.
What is the molecular weight of 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide?
The molecular weight of 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide is 244.13 g/mol.
Where can I buy 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide?
You can request a quote for 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-2-methyl-1-(2-phenylethyl)-1H-imidazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.