N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}benzene-1-sulfonamide
Chemical Structure Depiction of
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}benzene-1-sulfonamide
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 5588-0110 |
| Compound Name: | N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}benzene-1-sulfonamide |
| Molecular Weight: | 468.55 |
| Molecular Formula: | C21 H20 N6 O3 S2 |
| Smiles: | CCc1nnc(NS(c2ccc(cc2)N/C=C2\C(C)=NN(C2=O)c2ccccc2)(=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.2454 |
| logD: | 1.0596 |
| logSw: | -3.5919 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.878 |
| InChI Key: | HDKHUSGIFSBYMS-UHFFFAOYSA-N |