N-[(adamantan-1-yl)methyl]-6-methoxy-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-[(adamantan-1-yl)methyl]-6-methoxy-2-oxo-2H-1-benzopyran-3-carboxamide
N-[(adamantan-1-yl)methyl]-6-methoxy-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 8013-3891 |
| Compound Name: | N-[(adamantan-1-yl)methyl]-6-methoxy-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 367.44 |
| Molecular Formula: | C22 H25 N O4 |
| Smiles: | COc1ccc2c(C=C(C(NCC34CC5CC(CC(C5)C4)C3)=O)C(=O)O2)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.2467 |
| logD: | 4.2467 |
| logSw: | -4.5359 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.151 |
| InChI Key: | NMOVBJYGHOOFDI-UHFFFAOYSA-N |