N'-[1-(adamantan-1-yl)propan-2-ylidene]-5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbohydrazide
Chemical Structure Depiction of
N'-[1-(adamantan-1-yl)propan-2-ylidene]-5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbohydrazide
N'-[1-(adamantan-1-yl)propan-2-ylidene]-5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbohydrazide
Compound characteristics
| Compound ID: | Y503-3931 |
| Compound Name: | N'-[1-(adamantan-1-yl)propan-2-ylidene]-5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carbohydrazide |
| Molecular Weight: | 442.99 |
| Molecular Formula: | C24 H31 Cl N4 O2 |
| Smiles: | C/C(CC12CC3CC(CC(C3)C2)C1)=N/NC(c1ccc(Cn2c(C)c(c(C)n2)[Cl])o1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2679 |
| logD: | 5.2656 |
| logSw: | -5.7664 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.079 |
| InChI Key: | MBIYYHLCETUWPI-UHFFFAOYSA-N |