2-(1,3-benzothiazol-2-yl)-4-[(4-chlorophenyl)methylidene]-5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(1,3-benzothiazol-2-yl)-4-[(4-chlorophenyl)methylidene]-5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
2-(1,3-benzothiazol-2-yl)-4-[(4-chlorophenyl)methylidene]-5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y508-6236 |
| Compound Name: | 2-(1,3-benzothiazol-2-yl)-4-[(4-chlorophenyl)methylidene]-5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 496.44 |
| Molecular Formula: | C24 H15 Cl2 N3 O S2 |
| Smiles: | C(C1/C(=C\c2ccc(cc2)[Cl])C(N(c2nc3ccccc3s2)N=1)=O)Sc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.4988 |
| logD: | 7.4988 |
| logSw: | -6.6965 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.581 |
| InChI Key: | WIEOVGWWLSBLMX-UHFFFAOYSA-N |