N-[(adamantan-1-yl)methyl]-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-[(adamantan-1-yl)methyl]-2-oxo-2H-1-benzopyran-3-carboxamide
N-[(adamantan-1-yl)methyl]-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 8013-3794 |
| Compound Name: | N-[(adamantan-1-yl)methyl]-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 337.42 |
| Molecular Formula: | C21 H23 N O3 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)CNC(C1=Cc2ccccc2OC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2422 |
| logD: | 4.2421 |
| logSw: | -4.69 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.607 |
| InChI Key: | KIGFORUABVVZQJ-UHFFFAOYSA-N |