N-(3-chloro-4-fluorophenyl)-2-{[5-(piperidine-1-sulfonyl)-1H-indol-3-yl]methylidene}hydrazine-1-carbothioamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-{[5-(piperidine-1-sulfonyl)-1H-indol-3-yl]methylidene}hydrazine-1-carbothioamide
N-(3-chloro-4-fluorophenyl)-2-{[5-(piperidine-1-sulfonyl)-1H-indol-3-yl]methylidene}hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | C348-0024 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-{[5-(piperidine-1-sulfonyl)-1H-indol-3-yl]methylidene}hydrazine-1-carbothioamide |
| Molecular Weight: | 494.01 |
| Molecular Formula: | C21 H21 Cl F N5 O2 S2 |
| Smiles: | C1CCN(CC1)S(c1ccc2c(c1)c(/C=N/NC(Nc1ccc(c(c1)[Cl])F)=S)c[nH]2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3868 |
| logD: | 5.3866 |
| logSw: | -6.0537 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 72.867 |
| InChI Key: | GJOOVAIKRQFOGR-UHFFFAOYSA-N |