N-(3,4-dichlorophenyl)-4-(2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}ethyl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-(3,4-dichlorophenyl)-4-(2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}ethyl)piperazine-1-carboxamide
N-(3,4-dichlorophenyl)-4-(2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}ethyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | 3045-0281 |
| Compound Name: | N-(3,4-dichlorophenyl)-4-(2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}ethyl)piperazine-1-carboxamide |
| Molecular Weight: | 467.39 |
| Molecular Formula: | C22 H28 Cl2 N4 O3 |
| Smiles: | CC1(C)CC(C(=CNCCN2CCN(CC2)C(Nc2ccc(c(c2)[Cl])[Cl])=O)C(C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5516 |
| logD: | 1.9784 |
| logSw: | -3.3812 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.888 |
| InChI Key: | UHUVFHMGGAOLMV-UHFFFAOYSA-N |