N-cyclohexyl-4-(2-{[(2,6-dioxo-4-phenylcyclohexylidene)methyl]amino}ethyl)piperazine-1-carbothioamide
Chemical Structure Depiction of
N-cyclohexyl-4-(2-{[(2,6-dioxo-4-phenylcyclohexylidene)methyl]amino}ethyl)piperazine-1-carbothioamide
N-cyclohexyl-4-(2-{[(2,6-dioxo-4-phenylcyclohexylidene)methyl]amino}ethyl)piperazine-1-carbothioamide
Compound characteristics
| Compound ID: | 3946-1753 |
| Compound Name: | N-cyclohexyl-4-(2-{[(2,6-dioxo-4-phenylcyclohexylidene)methyl]amino}ethyl)piperazine-1-carbothioamide |
| Molecular Weight: | 468.66 |
| Molecular Formula: | C26 H36 N4 O2 S |
| Smiles: | C1CCC(CC1)NC(N1CCN(CCNC=C2C(CC(CC2=O)c2ccccc2)=O)CC1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.2924 |
| logD: | 2.457 |
| logSw: | -3.3989 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.093 |
| InChI Key: | FRDBPDDQWPSQHA-UHFFFAOYSA-N |