N-{2-[(3,5-dimethyladamantan-1-yl)oxy]ethyl}-2-(4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
Chemical Structure Depiction of
N-{2-[(3,5-dimethyladamantan-1-yl)oxy]ethyl}-2-(4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
N-{2-[(3,5-dimethyladamantan-1-yl)oxy]ethyl}-2-(4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
Compound characteristics
| Compound ID: | C660-0218 |
| Compound Name: | N-{2-[(3,5-dimethyladamantan-1-yl)oxy]ethyl}-2-(4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C26 H31 N3 O4 |
| Smiles: | CC12CC3CC(C)(C1)CC(C3)(C2)OCCNC(Cn1c2c3ccccc3OC(c2cn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0843 |
| logD: | 4.0843 |
| logSw: | -4.3729 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.032 |
| InChI Key: | WBAFKAJHQLDWCY-UHFFFAOYSA-N |