1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine
TL;DR: 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine (CAS 21444-68-8) is a chemical compound with molecular formula C13H13N3O and molecular weight 227.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-2-(5-methylfuran-2-yl)benzimidazol-5-amine
Also Known As: 1-Methyl-2-(5-methylfuran-2-yl)-1H-benzo[d]imidazol-5-amine, 1-methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-amine, AE-641/00654001, 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine, 1-methyl-2-(5-methylfuran-2-yl)benzimidazol-5-amine
| Molecular Formula | C13H13N3O |
|---|---|
| Molecular Weight | 227.11 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 57.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 227.10587 |
| Heavy Atoms | 17 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 21444-68-8 |
|---|---|
| SMILES | CC1=CC=C(O1)C2=NC3=C(N2C)C=CC(=C3)N |
| InChIKey | ZJGUHSOEWQNPHF-UHFFFAOYSA-N |
Product Overview
1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine (CAS 21444-68-8), with molecular formula C13H13N3O and molecular weight 227.11 g/mol. IUPAC: 1-methyl-2-(5-methylfuran-2-yl)benzimidazol-5-amine.
Chemical Property Profile of 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine
Property Insights of 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine. With a topological polar surface area (TPSA) of 57.0 Ų, 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine has 1 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 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine?
The CAS number of 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine is 21444-68-8.
What is the molecular formula of 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine?
The molecular formula of 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine is C13H13N3O.
What is the molecular weight of 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine?
The molecular weight of 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine is 227.11 g/mol.
Where can I buy 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine?
You can request a quote for 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-2-(5-methyl-2-furyl)-1H-benzimidazol-5-ylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.