N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-methyladamantane-1-carboxamide
Chemical Structure Depiction of
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-methyladamantane-1-carboxamide
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-methyladamantane-1-carboxamide
Compound characteristics
| Compound ID: | 1269-0729 |
| Compound Name: | N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-methyladamantane-1-carboxamide |
| Molecular Weight: | 379.5 |
| Molecular Formula: | C23 H29 N3 O2 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC(C12CC3CC(CC(C)(C3)C2)C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4132 |
| logD: | 3.0587 |
| logSw: | -3.6914 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.744 |
| InChI Key: | GIQAEFHRBOMOMH-UHFFFAOYSA-N |