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6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine
TL;DR: 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine (CAS 501688-77-3) is a chemical compound with molecular formula C8H8ClN3 and molecular weight 181.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-methyl-1H-benzimidazol-4-amine
Also Known As: 5-chloro-2-methyl-1H-1,3-benzodiazol-7-amine, 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine, 6-chloro-2-methyl-1H-benzimidazol-4-amine, 1H-Benzimidazol-4-amine,7-dihydro-2-methyl-, 1H-Benzimidazol-4-amine, 6-chloro-2-methyl- (9CI)
| Molecular Formula | C8H8ClN3 |
|---|---|
| Molecular Weight | 181.04 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 181.04068 |
| Heavy Atoms | 12 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 501688-77-3 |
|---|---|
| SMILES | CC1=NC2=C(C=C(C=C2N1)Cl)N |
| InChIKey | MBRXTPLHDORLEE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine (CAS 501688-77-3), with molecular formula C8H8ClN3 and molecular weight 181.04 g/mol. IUPAC: 6-chloro-2-methyl-1H-benzimidazol-4-amine.
Chemical Property Profile of 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine
Property Insights of 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine. With a topological polar surface area (TPSA) of 54.7 Ų, 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine has 2 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 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine?
The CAS number of 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine is 501688-77-3.
What is the molecular formula of 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine?
The molecular formula of 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine is C8H8ClN3.
What is the molecular weight of 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine?
The molecular weight of 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine is 181.04 g/mol.
Where can I buy 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine?
You can request a quote for 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-2-methyl-1H-benzo[d]imidazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.