N-(1-{1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}cyclohexyl)-2,3-dihydro-1,4-benzodioxin-6-amine
Chemical Structure Depiction of
N-(1-{1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}cyclohexyl)-2,3-dihydro-1,4-benzodioxin-6-amine
N-(1-{1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}cyclohexyl)-2,3-dihydro-1,4-benzodioxin-6-amine
Compound characteristics
| Compound ID: | J034-1501 |
| Compound Name: | N-(1-{1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}cyclohexyl)-2,3-dihydro-1,4-benzodioxin-6-amine |
| Molecular Weight: | 445.44 |
| Molecular Formula: | C22 H22 F3 N5 O2 |
| Smiles: | C1CCC(CC1)(c1nnnn1c1cccc(c1)C(F)(F)F)Nc1ccc2c(c1)OCCO2 |
| Stereo: | ACHIRAL |
| logP: | 4.2572 |
| logD: | 4.2572 |
| logSw: | -4.3533 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.129 |
| InChI Key: | ZSFMHKVGTXDRFI-UHFFFAOYSA-N |