ethyl 2-(6,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzoate
Chemical Structure Depiction of
ethyl 2-(6,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzoate
ethyl 2-(6,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzoate
Compound characteristics
| Compound ID: | 8018-4225 |
| Compound Name: | ethyl 2-(6,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzoate |
| Molecular Weight: | 312.37 |
| Molecular Formula: | C18 H20 N2 O3 |
| Smiles: | CCOC(c1ccccc1n1c2CC(C)(C)CC(c2cn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4837 |
| logD: | 3.4837 |
| logSw: | -3.6322 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.909 |
| InChI Key: | MBXNTSHAISKGEJ-UHFFFAOYSA-N |