2-({4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(3-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-({4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(3-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
2-({4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(3-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-9124 |
| Compound Name: | 2-({4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(3-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 563.68 |
| Molecular Formula: | C33 H29 N3 O4 S |
| Smiles: | Cc1cccc(CN2C(/C(=C\c3ccc(cc3)C(N3CCN(CC3)C(c3ccco3)=O)=O)Sc3ccccc23)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.4117 |
| logD: | 5.4117 |
| logSw: | -5.3648 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.752 |
| InChI Key: | PKVMYTJVLGGUHK-UHFFFAOYSA-N |