N-(4-chlorophenyl)-N-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]adamantane-1-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-N-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]adamantane-1-carboxamide
N-(4-chlorophenyl)-N-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]adamantane-1-carboxamide
Compound characteristics
| Compound ID: | 0831-0528 |
| Compound Name: | N-(4-chlorophenyl)-N-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]adamantane-1-carboxamide |
| Molecular Weight: | 491.03 |
| Molecular Formula: | C29 H31 Cl N2 O3 |
| Smiles: | C(CCN(C(C12CC3CC(CC(C3)C2)C1)=O)c1ccc(cc1)[Cl])CN1C(c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5832 |
| logD: | 6.5832 |
| logSw: | -6.4454 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.104 |
| InChI Key: | BNVCTGXADWYJGC-UHFFFAOYSA-N |