N-{1-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]cyclohexyl}-3,4-dimethoxyaniline
Chemical Structure Depiction of
N-{1-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]cyclohexyl}-3,4-dimethoxyaniline
N-{1-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]cyclohexyl}-3,4-dimethoxyaniline
Compound characteristics
| Compound ID: | J034-1188 |
| Compound Name: | N-{1-[1-(4-chlorophenyl)-1H-tetrazol-5-yl]cyclohexyl}-3,4-dimethoxyaniline |
| Molecular Weight: | 413.91 |
| Molecular Formula: | C21 H24 Cl N5 O2 |
| Smiles: | COc1ccc(cc1OC)NC1(CCCCC1)c1nnnn1c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5627 |
| logD: | 4.5627 |
| logSw: | -4.7317 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.566 |
| InChI Key: | ROCIXUAOVQDWPT-UHFFFAOYSA-N |