N,N-dimethyl-3-{4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-phenyl-1H-pyrazol-3-yl}benzene-1-sulfonamide
Chemical Structure Depiction of
N,N-dimethyl-3-{4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-phenyl-1H-pyrazol-3-yl}benzene-1-sulfonamide
N,N-dimethyl-3-{4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-phenyl-1H-pyrazol-3-yl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y070-3219 |
| Compound Name: | N,N-dimethyl-3-{4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-phenyl-1H-pyrazol-3-yl}benzene-1-sulfonamide |
| Molecular Weight: | 484.62 |
| Molecular Formula: | C22 H20 N4 O3 S3 |
| Smiles: | CN1C(/C(=C/c2cn(c3ccccc3)nc2c2cccc(c2)S(N(C)C)(=O)=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5745 |
| logD: | 3.5745 |
| logSw: | -3.8085 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 64.776 |
| InChI Key: | NMKMWAVMKKBDTM-UHFFFAOYSA-N |