N-(2-methylphenyl)-2-{2-oxo-1-[(4-phenylpiperazin-1-yl)methyl]-1,2-dihydro-3H-indol-3-ylidene}hydrazine-1-carbothioamide
Chemical Structure Depiction of
N-(2-methylphenyl)-2-{2-oxo-1-[(4-phenylpiperazin-1-yl)methyl]-1,2-dihydro-3H-indol-3-ylidene}hydrazine-1-carbothioamide
N-(2-methylphenyl)-2-{2-oxo-1-[(4-phenylpiperazin-1-yl)methyl]-1,2-dihydro-3H-indol-3-ylidene}hydrazine-1-carbothioamide
Compound characteristics
Compound ID: | K786-1366 |
Compound Name: | N-(2-methylphenyl)-2-{2-oxo-1-[(4-phenylpiperazin-1-yl)methyl]-1,2-dihydro-3H-indol-3-ylidene}hydrazine-1-carbothioamide |
Molecular Weight: | 484.62 |
Molecular Formula: | C27 H28 N6 O S |
Smiles: | Cc1ccccc1NC(N/N=C1C(N(CN2CCN(CC2)c2ccccc2)c2ccccc/12)=O)=S |
Stereo: | ACHIRAL |
logP: | 4.8546 |
logD: | 4.8478 |
logSw: | -4.4292 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 53.309 |
InChI Key: | DCRSCPFAPBCCGC-UHFFFAOYSA-N |