N-[(5-methyl-1,2-benzoxazol-3-yl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-[(5-methyl-1,2-benzoxazol-3-yl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
N-[(5-methyl-1,2-benzoxazol-3-yl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | E569-0147 |
| Compound Name: | N-[(5-methyl-1,2-benzoxazol-3-yl)methyl]-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide |
| Molecular Weight: | 418.42 |
| Molecular Formula: | C21 H21 F3 N4 O2 |
| Smiles: | Cc1ccc2c(c1)c(CNC(N1CCN(CC1)c1cccc(c1)C(F)(F)F)=O)no2 |
| Stereo: | ACHIRAL |
| logP: | 4.2065 |
| logD: | 4.2058 |
| logSw: | -4.2706 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.984 |
| InChI Key: | RHKQURWVBYITDP-UHFFFAOYSA-N |