N,N-dimethyl-4-(4-{[3-(2-methylpropyl)-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-4-(4-{[3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-1-phenyl-1H-pyrazol-3-yl)benzene-1-sulfonamide
N,N-dimethyl-4-(4-{[3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-1-phenyl-1H-pyrazol-3-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 4476-1066 |
| Compound Name: | N,N-dimethyl-4-(4-{[3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-1-phenyl-1H-pyrazol-3-yl)benzene-1-sulfonamide |
| Molecular Weight: | 526.7 |
| Molecular Formula: | C25 H26 N4 O3 S3 |
| Smiles: | CC(C)CN1C(/C(=C/c2cn(c3ccccc3)nc2c2ccc(cc2)S(N(C)C)(=O)=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9822 |
| logD: | 4.9822 |
| logSw: | -4.4501 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 65.01 |
| InChI Key: | ZMEOQWYDWNDCNH-UHFFFAOYSA-N |