2-({4-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-({4-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzothiazin-3(4H)-one
2-({4-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-3302 |
| Compound Name: | 2-({4-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]phenyl}methylidene)-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 469.61 |
| Molecular Formula: | C28 H27 N3 O2 S |
| Smiles: | CC1CN(CCN1c1cccc(C)c1)C(c1ccc(\C=C2/C(Nc3ccccc3S2)=O)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.975 |
| logD: | 4.975 |
| logSw: | -4.5902 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.972 |
| InChI Key: | ZIBMHYWJAOPCJI-FQEVSTJZSA-N |