4-methyl-N-[5-({3-[2-methyl-5-(propan-2-yl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide
Chemical Structure Depiction of
4-methyl-N-[5-({3-[2-methyl-5-(propan-2-yl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide
4-methyl-N-[5-({3-[2-methyl-5-(propan-2-yl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide
Compound characteristics
| Compound ID: | 4476-3349 |
| Compound Name: | 4-methyl-N-[5-({3-[2-methyl-5-(propan-2-yl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide |
| Molecular Weight: | 552.72 |
| Molecular Formula: | C31 H28 N4 O2 S2 |
| Smiles: | CC(C)c1ccc(C)c(c1)c1c(/C=C2/C(N(C(=S)S2)NC(c2ccc(C)cc2)=O)=O)cn(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.1612 |
| logD: | 7.1297 |
| logSw: | -5.6121 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.476 |
| InChI Key: | CMAKTUUNSODQBX-UHFFFAOYSA-N |