(3S,5R)-3-benzyl-5-(hydroxymethyl)-1-methyl-4-{[4-(trifluoromethoxy)phenyl]methyl}piperazin-2-one
Chemical Structure Depiction of
(3S,5R)-3-benzyl-5-(hydroxymethyl)-1-methyl-4-{[4-(trifluoromethoxy)phenyl]methyl}piperazin-2-one
(3S,5R)-3-benzyl-5-(hydroxymethyl)-1-methyl-4-{[4-(trifluoromethoxy)phenyl]methyl}piperazin-2-one
Compound characteristics
| Compound ID: | S973-0219 |
| Compound Name: | (3S,5R)-3-benzyl-5-(hydroxymethyl)-1-methyl-4-{[4-(trifluoromethoxy)phenyl]methyl}piperazin-2-one |
| Molecular Weight: | 408.42 |
| Molecular Formula: | C21 H23 F3 N2 O3 |
| Smiles: | CN1C[C@H](CO)N(Cc2ccc(cc2)OC(F)(F)F)[C@@H](Cc2ccccc2)C1=O |
| Stereo: | ABSOLUTE |
| logP: | 3.7199 |
| logD: | 3.7184 |
| logSw: | -4.0265 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.199 |
| InChI Key: | ZCPRNWUMHODGNJ-MJGOQNOKSA-N |