1H-1,3-benzodiazol-1-amine
TL;DR: 1H-1,3-benzodiazol-1-amine (CAS 6960-64-1) is a chemical compound with molecular formula C7H7N3 and molecular weight 133.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzimidazol-1-amine
Also Known As: 1H-benzimidazol-1-amine, benzimidazol-1-amine, aminobenzimidazole, 1-aminobenzimidazole, 1H-1,3-benzodiazol-1-amine
| Molecular Formula | C7H7N3 |
|---|---|
| Molecular Weight | 133.06 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 133.064 |
| Heavy Atoms | 10 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 6960-64-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=CN2N |
| InChIKey | HXYXDTAROKJMBO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-1,3-benzodiazol-1-amine (CAS 6960-64-1), with molecular formula C7H7N3 and molecular weight 133.06 g/mol. IUPAC: benzimidazol-1-amine.
Chemical Property Profile of 1H-1,3-benzodiazol-1-amine
Property Insights of 1H-1,3-benzodiazol-1-amine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-1,3-benzodiazol-1-amine. With a topological polar surface area (TPSA) of 43.8 Ų, 1H-1,3-benzodiazol-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-1,3-benzodiazol-1-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 1H-1,3-benzodiazol-1-amine?
The CAS number of 1H-1,3-benzodiazol-1-amine is 6960-64-1.
What is the molecular formula of 1H-1,3-benzodiazol-1-amine?
The molecular formula of 1H-1,3-benzodiazol-1-amine is C7H7N3.
What is the molecular weight of 1H-1,3-benzodiazol-1-amine?
The molecular weight of 1H-1,3-benzodiazol-1-amine is 133.06 g/mol.
Where can I buy 1H-1,3-benzodiazol-1-amine?
You can request a quote for 1H-1,3-benzodiazol-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,3-benzodiazol-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,3-benzodiazol-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.