N-[2-(cyclohex-1-en-1-yl)ethyl]-1-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-1H-benzimidazole-6-carboxamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-1-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-1H-benzimidazole-6-carboxamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-1-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-1H-benzimidazole-6-carboxamide
Compound characteristics
| Compound ID: | E226-1212 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-1-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-1H-benzimidazole-6-carboxamide |
| Molecular Weight: | 419.59 |
| Molecular Formula: | C25 H29 N3 O S |
| Smiles: | Cc1ccc(CSc2nc3ccc(cc3n2C)C(NCCC2CCCCC=2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1863 |
| logD: | 5.1862 |
| logSw: | -4.8859 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.006 |
| InChI Key: | JNWWJDMUUWPKTQ-UHFFFAOYSA-N |