N-{2-[(adamantan-1-yl)oxy]ethyl}-6-methoxy-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-{2-[(adamantan-1-yl)oxy]ethyl}-6-methoxy-2-oxo-2H-1-benzopyran-3-carboxamide
N-{2-[(adamantan-1-yl)oxy]ethyl}-6-methoxy-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 8013-3894 |
| Compound Name: | N-{2-[(adamantan-1-yl)oxy]ethyl}-6-methoxy-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 397.47 |
| Molecular Formula: | C23 H27 N O5 |
| Smiles: | COc1ccc2c(C=C(C(NCCOC34CC5CC(CC(C5)C4)C3)=O)C(=O)O2)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.8754 |
| logD: | 3.8754 |
| logSw: | -4.2636 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.22 |
| InChI Key: | LKNRQXSZXRIHGW-UHFFFAOYSA-N |