1-methyl-1H-1,3-benzodiazol-5-amine
TL;DR: 1-methyl-1H-1,3-benzodiazol-5-amine (CAS 90764-88-8) is a chemical compound with molecular formula C8H9N3 and molecular weight 147.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylbenzimidazol-5-amine
Also Known As: 1-methylbenzoimidazol-5-amine, 1-methylbenzimidazol-5-amine, 1-methyl-1H-benzimidazol-5-amine, 1-methyl-1H-benzo[d]imidazol-5-amine, 1-Methyl-1H-benzoimidazol-5-ylamine
| Molecular Formula | C8H9N3 |
|---|---|
| Molecular Weight | 147.08 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 147.07965 |
| Heavy Atoms | 11 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 90764-88-8 |
|---|---|
| SMILES | CN1C=NC2=C1C=CC(=C2)N |
| InChIKey | IWBGBYZGEQUDBT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-methyl-1H-1,3-benzodiazol-5-amine (CAS 90764-88-8), with molecular formula C8H9N3 and molecular weight 147.08 g/mol. IUPAC: 1-methylbenzimidazol-5-amine.
Chemical Property Profile of 1-methyl-1H-1,3-benzodiazol-5-amine
Property Insights of 1-methyl-1H-1,3-benzodiazol-5-amine
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-methyl-1H-1,3-benzodiazol-5-amine. With a topological polar surface area (TPSA) of 43.8 Ų, 1-methyl-1H-1,3-benzodiazol-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-methyl-1H-1,3-benzodiazol-5-amine has 1 hydrogen bond donor(s) and 2 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-1H-1,3-benzodiazol-5-amine?
The CAS number of 1-methyl-1H-1,3-benzodiazol-5-amine is 90764-88-8.
What is the molecular formula of 1-methyl-1H-1,3-benzodiazol-5-amine?
The molecular formula of 1-methyl-1H-1,3-benzodiazol-5-amine is C8H9N3.
What is the molecular weight of 1-methyl-1H-1,3-benzodiazol-5-amine?
The molecular weight of 1-methyl-1H-1,3-benzodiazol-5-amine is 147.08 g/mol.
Where can I buy 1-methyl-1H-1,3-benzodiazol-5-amine?
You can request a quote for 1-methyl-1H-1,3-benzodiazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-methyl-1H-1,3-benzodiazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-methyl-1H-1,3-benzodiazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.