6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-4-methyl-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-4-methyl-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-4-methyl-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C310-3009 |
| Compound Name: | 6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-4-methyl-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 558.02 |
| Molecular Formula: | C28 H23 Cl F3 N3 O2 S |
| Smiles: | CN1C(/C(=C/c2ccc(cc2)C(F)(F)F)Sc2ccc(cc12)C(N1CCN(CC1)c1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7823 |
| logD: | 5.7823 |
| logSw: | -6.1447 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.015 |
| InChI Key: | ODVKLNANWYTSNB-UHFFFAOYSA-N |