5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one
TL;DR: 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one (CAS 67014-36-2) is a chemical compound with molecular formula C8H9N3O and molecular weight 163.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-6-methyl-1,3-dihydrobenzimidazol-2-one
Also Known As: 5-Amino-6-methylbenzimidazolone, 5-amino-6-methyl-2-benzimidazolone, 5-Amino-6-methyl benzimidazolone, 5-Amino-6-methyl-1H-benzo[d]imidazol-2(3H)-one, 5-Amino-6-methyl-1,3-dihydrobenzoimidazol-2-one
| Molecular Formula | C8H9N3O |
|---|---|
| Molecular Weight | 163.07 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 163.07455 |
| Heavy Atoms | 12 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 67014-36-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1N)NC(=O)N2 |
| InChIKey | ZCXIPVIGYBHUTQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one (CAS 67014-36-2), with molecular formula C8H9N3O and molecular weight 163.07 g/mol. IUPAC: 5-amino-6-methyl-1,3-dihydrobenzimidazol-2-one.
Chemical Property Profile of 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one
Property Insights of 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one. Following Lipinski's Rule of Five, 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one has 3 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 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one?
The CAS number of 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one is 67014-36-2.
What is the molecular formula of 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one?
The molecular formula of 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one is C8H9N3O.
What is the molecular weight of 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one?
The molecular weight of 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one is 163.07 g/mol.
Where can I buy 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one?
You can request a quote for 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.