2-{1-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}-N-(2,3-dimethylphenyl)hydrazine-1-carbothioamide
Chemical Structure Depiction of
2-{1-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}-N-(2,3-dimethylphenyl)hydrazine-1-carbothioamide
2-{1-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}-N-(2,3-dimethylphenyl)hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | K786-4335 |
| Compound Name: | 2-{1-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}-N-(2,3-dimethylphenyl)hydrazine-1-carbothioamide |
| Molecular Weight: | 469.61 |
| Molecular Formula: | C27 H27 N5 O S |
| Smiles: | Cc1cccc(c1C)NC(N/N=C1C(N(CN2CCc3ccccc3C2)c2ccccc/12)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 6.0493 |
| logD: | 6.0155 |
| logSw: | -5.4289 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.711 |
| InChI Key: | PPMOYKVDXQXHNP-UHFFFAOYSA-N |