2-({4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(4-fluorophenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-({4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(4-fluorophenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
2-({4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(4-fluorophenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C308-0693 |
| Compound Name: | 2-({4-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(4-fluorophenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 577.72 |
| Molecular Formula: | C35 H32 F N3 O2 S |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C(c1ccc(/C=C2/C(N(Cc3ccc(cc3)F)c3ccccc3S2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.3449 |
| logD: | 7.3449 |
| logSw: | -5.7262 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.677 |
| InChI Key: | ZYKPEDPWMWBKKX-UHFFFAOYSA-N |