2-(1,3-benzothiazol-2-yl)-4-chloro-5-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyridazin-3(2H)-one
Chemical Structure Depiction of
2-(1,3-benzothiazol-2-yl)-4-chloro-5-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyridazin-3(2H)-one
2-(1,3-benzothiazol-2-yl)-4-chloro-5-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | C301-2867 |
| Compound Name: | 2-(1,3-benzothiazol-2-yl)-4-chloro-5-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyridazin-3(2H)-one |
| Molecular Weight: | 491.92 |
| Molecular Formula: | C22 H17 Cl F3 N5 O S |
| Smiles: | C1CN(CCN1C1C=NN(C(C=1[Cl])=O)c1nc2ccccc2s1)c1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.4365 |
| logD: | 5.4365 |
| logSw: | -6.1519 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 43.783 |
| InChI Key: | LKGUJJIYJXGGKI-UHFFFAOYSA-N |