4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide
TL;DR: 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide (CAS 300591-43-9) is a chemical compound with molecular formula C12H15N3O and molecular weight 217.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxyspiro[benzimidazole-2,1'-cyclohexane]-4-imine
Also Known As: 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide, spiro[benzimidazole-2,1'-cyclohexan]-4-amine 1-oxide, 4-aminospiro[benzo[d]imidazole-2,1'-cyclohexane] 1-oxide, 1-hydroxy-4-spiro[benzimidazole-2,1''-cyclohexane]imine, 1-hydroxyspiro[benzimidazole-2,1''-cyclohexane]-4-imine
| Molecular Formula | C12H15N3O |
|---|---|
| Molecular Weight | 217.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 59.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 217.1215 |
| Heavy Atoms | 16 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 300591-43-9 |
|---|---|
| SMILES | C1CCC2(CC1)N=C3C(=N)C=CC=C3N2O |
| InChIKey | JMASVDSCQHVISD-UHFFFAOYSA-N |
Product Overview
4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide (CAS 300591-43-9), with molecular formula C12H15N3O and molecular weight 217.12 g/mol. IUPAC: 1-hydroxyspiro[benzimidazole-2,1'-cyclohexane]-4-imine.
Chemical Property Profile of 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide
Property Insights of 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide. With a topological polar surface area (TPSA) of 59.7 Ų, 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide has 2 hydrogen bond donor(s) and 4 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 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide?
The CAS number of 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide is 300591-43-9.
What is the molecular formula of 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide?
The molecular formula of 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide is C12H15N3O.
What is the molecular weight of 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide?
The molecular weight of 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide is 217.12 g/mol.
Where can I buy 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide?
You can request a quote for 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-2-spirocyclohexyl-2H-benzimidazol-1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.