N-(adamantan-1-yl)-4-(2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}ethyl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-(adamantan-1-yl)-4-(2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}ethyl)piperazine-1-carboxamide
N-(adamantan-1-yl)-4-(2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}ethyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | 3046-8001 |
| Compound Name: | N-(adamantan-1-yl)-4-(2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}ethyl)piperazine-1-carboxamide |
| Molecular Weight: | 456.63 |
| Molecular Formula: | C26 H40 N4 O3 |
| Smiles: | CC1(C)CC(C(=CNCCN2CCN(CC2)C(NC23CC4CC(CC(C4)C3)C2)=O)C(C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0834 |
| logD: | 1.1843 |
| logSw: | -2.6364 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.906 |
| InChI Key: | QAFNEBOIXAGLRD-UHFFFAOYSA-N |