methyl 4-({2-[3-(adamantan-1-yl)-1H-pyrazole-5-carbonyl]hydrazinylidene}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({2-[3-(adamantan-1-yl)-1H-pyrazole-5-carbonyl]hydrazinylidene}methyl)benzoate
methyl 4-({2-[3-(adamantan-1-yl)-1H-pyrazole-5-carbonyl]hydrazinylidene}methyl)benzoate
Compound characteristics
| Compound ID: | 2323-2135 |
| Compound Name: | methyl 4-({2-[3-(adamantan-1-yl)-1H-pyrazole-5-carbonyl]hydrazinylidene}methyl)benzoate |
| Molecular Weight: | 406.48 |
| Molecular Formula: | C23 H26 N4 O3 |
| Smiles: | COC(c1ccc(/C=N/NC(c2cc(C34CC5CC(CC(C5)C4)C3)n[nH]2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2358 |
| logD: | 5.2339 |
| logSw: | -5.216 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.251 |
| InChI Key: | MORLEGSEVUUDJT-UHFFFAOYSA-N |