3-{4-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-phenyl-1H-pyrazol-3-yl}-N,N-dimethylbenzene-1-sulfonamide
Chemical Structure Depiction of
3-{4-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-phenyl-1H-pyrazol-3-yl}-N,N-dimethylbenzene-1-sulfonamide
3-{4-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-phenyl-1H-pyrazol-3-yl}-N,N-dimethylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y070-3218 |
| Compound Name: | 3-{4-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-phenyl-1H-pyrazol-3-yl}-N,N-dimethylbenzene-1-sulfonamide |
| Molecular Weight: | 498.64 |
| Molecular Formula: | C23 H22 N4 O3 S3 |
| Smiles: | CCN1C(/C(=C/c2cn(c3ccccc3)nc2c2cccc(c2)S(N(C)C)(=O)=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2081 |
| logD: | 4.2081 |
| logSw: | -4.1994 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 64.735 |
| InChI Key: | OKYCVBDVSZWLDY-UHFFFAOYSA-N |