N-{1-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]-4-methylcyclohexyl}-2H-1,3-benzodioxol-5-amine
Chemical Structure Depiction of
N-{1-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]-4-methylcyclohexyl}-2H-1,3-benzodioxol-5-amine
N-{1-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]-4-methylcyclohexyl}-2H-1,3-benzodioxol-5-amine
Compound characteristics
| Compound ID: | J034-0736 |
| Compound Name: | N-{1-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]-4-methylcyclohexyl}-2H-1,3-benzodioxol-5-amine |
| Molecular Weight: | 405.5 |
| Molecular Formula: | C23 H27 N5 O2 |
| Smiles: | CC1CCC(CC1)(c1nnnn1c1c(C)cccc1C)Nc1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 5.5162 |
| logD: | 5.5161 |
| logSw: | -5.5731 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.819 |
| InChI Key: | JTXCQHQRYCMWCJ-UHFFFAOYSA-N |