N-{1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}-2,3-dihydro-1H-indole-1-carbothioamide
Chemical Structure Depiction of
N-{1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}-2,3-dihydro-1H-indole-1-carbothioamide
N-{1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}-2,3-dihydro-1H-indole-1-carbothioamide
Compound characteristics
| Compound ID: | Y502-3490 |
| Compound Name: | N-{1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}-2,3-dihydro-1H-indole-1-carbothioamide |
| Molecular Weight: | 348.47 |
| Molecular Formula: | C20 H20 N4 S |
| Smiles: | Cc1ccccc1Cn1cc(cn1)NC(N1CCc2ccccc12)=S |
| Stereo: | ACHIRAL |
| logP: | 4.4606 |
| logD: | 4.4606 |
| logSw: | -4.0066 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.6728 |
| InChI Key: | KBFPMGNHLULFJM-UHFFFAOYSA-N |