3-[4-(adamantan-1-yl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[4-(adamantan-1-yl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
3-[4-(adamantan-1-yl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 8013-3795 |
| Compound Name: | 3-[4-(adamantan-1-yl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 392.5 |
| Molecular Formula: | C24 H28 N2 O3 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)N1CCN(CC1)C(C1=Cc2ccccc2OC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9797 |
| logD: | 3.9262 |
| logSw: | -4.4552 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.761 |
| InChI Key: | UMFDTMZNGAGUQC-UHFFFAOYSA-N |