2-benzylidene-6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-4-[(4-fluorophenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-benzylidene-6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-4-[(4-fluorophenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
2-benzylidene-6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-4-[(4-fluorophenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-8689 |
| Compound Name: | 2-benzylidene-6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-4-[(4-fluorophenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 598.14 |
| Molecular Formula: | C34 H29 Cl F N3 O2 S |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(c1ccc2c(c1)N(Cc1ccc(cc1)F)C(/C(=C/c1ccccc1)S2)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.5217 |
| logD: | 7.5217 |
| logSw: | -6.2099 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.677 |
| InChI Key: | NPYADQFQYOVVSP-UHFFFAOYSA-N |