N-(2-methylphenyl)-2-[2-oxo-1-({4-[3-(trifluoromethyl)phenyl]piperazin-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-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-1,2-dihydro-3H-indol-3-ylidene]hydrazine-1-carbothioamide
N-(2-methylphenyl)-2-[2-oxo-1-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-1,2-dihydro-3H-indol-3-ylidene]hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | K786-1372 |
| Compound Name: | N-(2-methylphenyl)-2-[2-oxo-1-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-1,2-dihydro-3H-indol-3-ylidene]hydrazine-1-carbothioamide |
| Molecular Weight: | 552.62 |
| Molecular Formula: | C28 H27 F3 N6 O S |
| Smiles: | Cc1ccccc1NC(N/N=C1C(N(CN2CCN(CC2)c2cccc(c2)C(F)(F)F)c2ccccc/12)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 5.6553 |
| logD: | 5.6485 |
| logSw: | -5.5385 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.309 |
| InChI Key: | KDATUBOOGJUOEG-UHFFFAOYSA-N |