2-{1-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}-N-(3-methoxyphenyl)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-(3-methoxyphenyl)hydrazine-1-carbothioamide
2-{1-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}-N-(3-methoxyphenyl)hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | K786-4372 |
| Compound Name: | 2-{1-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}-N-(3-methoxyphenyl)hydrazine-1-carbothioamide |
| Molecular Weight: | 471.58 |
| Molecular Formula: | C26 H25 N5 O2 S |
| Smiles: | COc1cccc(c1)NC(N/N=C1C(N(CN2CCc3ccccc3C2)c2ccccc/12)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 5.244 |
| logD: | 5.2102 |
| logSw: | -4.971 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.953 |
| InChI Key: | DEHCQXMWEAFAHN-UHFFFAOYSA-N |