4-{[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-{[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide
4-{[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 5588-0109 |
| Compound Name: | 4-{[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide |
| Molecular Weight: | 439.51 |
| Molecular Formula: | C20 H17 N5 O3 S2 |
| Smiles: | CC1\C(=C/Nc2ccc(cc2)S(Nc2nccs2)(=O)=O)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.84 |
| logD: | 2.4303 |
| logSw: | -3.52 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.316 |
| InChI Key: | FPDSCGVJPYCFHD-UHFFFAOYSA-N |