4-{[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-{[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
4-{[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8010-2464 |
| Compound Name: | 4-{[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 331.37 |
| Molecular Formula: | C15 H14 F N5 O S |
| Smiles: | CCc1nnc(N/C=C2/C(C)=NN(C2=O)c2ccc(cc2)F)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.7545 |
| logD: | 2.5245 |
| logSw: | -3.0132 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.228 |
| InChI Key: | HLSUCRKRYYFKLK-UHFFFAOYSA-N |