N-[2-(4-chlorophenyl)ethyl]-4-(3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-4-(3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzamide
N-[2-(4-chlorophenyl)ethyl]-4-(3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzamide
Compound characteristics
| Compound ID: | G904-0406 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-4-(3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzamide |
| Molecular Weight: | 435.95 |
| Molecular Formula: | C25 H26 Cl N3 O2 |
| Smiles: | Cc1c2C(CC(C)(C)Cc2n(c2ccc(cc2)C(NCCc2ccc(cc2)[Cl])=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7022 |
| logD: | 3.7022 |
| logSw: | -4.8135 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.064 |
| InChI Key: | ABCADQNJKOGNBS-UHFFFAOYSA-N |