2-({4-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(2-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-({4-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(2-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
2-({4-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(2-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-9029 |
| Compound Name: | 2-({4-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]phenyl}methylidene)-4-[(2-methylphenyl)methyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 573.76 |
| Molecular Formula: | C36 H35 N3 O2 S |
| Smiles: | CC1CN(CCN1c1cccc(C)c1)C(c1ccc(\C=C2/C(N(Cc3ccccc3C)c3ccccc3S2)=O)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.6908 |
| logD: | 7.6907 |
| logSw: | -5.6192 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.197 |
| InChI Key: | FHAHNUNAXMXYJI-MHZLTWQESA-N |