N-{1-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]-4-methylcyclohexyl}-2,3-dihydro-1,4-benzodioxin-6-amine
Chemical Structure Depiction of
N-{1-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]-4-methylcyclohexyl}-2,3-dihydro-1,4-benzodioxin-6-amine
N-{1-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]-4-methylcyclohexyl}-2,3-dihydro-1,4-benzodioxin-6-amine
Compound characteristics
| Compound ID: | J034-0742 |
| Compound Name: | N-{1-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]-4-methylcyclohexyl}-2,3-dihydro-1,4-benzodioxin-6-amine |
| Molecular Weight: | 419.53 |
| Molecular Formula: | C24 H29 N5 O2 |
| Smiles: | CC1CCC(CC1)(c1nnnn1c1c(C)cccc1C)Nc1ccc2c(c1)OCCO2 |
| Stereo: | ACHIRAL |
| logP: | 4.6556 |
| logD: | 4.6556 |
| logSw: | -4.4374 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.527 |
| InChI Key: | CENKDUMFLFPEON-UHFFFAOYSA-N |