2-{2-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-2-oxoethylidene}-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-{2-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-2-oxoethylidene}-2H-1,4-benzothiazin-3(4H)-one
2-{2-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-2-oxoethylidene}-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C306-0578 |
| Compound Name: | 2-{2-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-2-oxoethylidene}-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 393.51 |
| Molecular Formula: | C22 H23 N3 O2 S |
| Smiles: | CC1CN(CCN1c1cccc(C)c1)C(/C=C1/C(Nc2ccccc2S1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.686 |
| logD: | 3.6859 |
| logSw: | -3.9207 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.716 |
| InChI Key: | FSHHXOQDQNRMHE-INIZCTEOSA-N |