N-{2-[(adamantan-1-yl)oxy]ethyl}-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-{2-[(adamantan-1-yl)oxy]ethyl}-2-oxo-2H-1-benzopyran-3-carboxamide
N-{2-[(adamantan-1-yl)oxy]ethyl}-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 8012-8042 |
| Compound Name: | N-{2-[(adamantan-1-yl)oxy]ethyl}-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 367.44 |
| Molecular Formula: | C22 H25 N O4 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)OCCNC(C1=Cc2ccccc2OC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8708 |
| logD: | 3.8708 |
| logSw: | -4.4119 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.676 |
| InChI Key: | XBSMZUOKSVQCIV-UHFFFAOYSA-N |