2-[(3-methoxyphenyl)methylidene]-4-methyl-6-[3-methyl-4-(4-methylphenyl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-[(3-methoxyphenyl)methylidene]-4-methyl-6-[3-methyl-4-(4-methylphenyl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
2-[(3-methoxyphenyl)methylidene]-4-methyl-6-[3-methyl-4-(4-methylphenyl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C310-2769 |
| Compound Name: | 2-[(3-methoxyphenyl)methylidene]-4-methyl-6-[3-methyl-4-(4-methylphenyl)piperazine-1-carbonyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 513.66 |
| Molecular Formula: | C30 H31 N3 O3 S |
| Smiles: | CC1CN(CCN1c1ccc(C)cc1)C(c1ccc2c(c1)N(C)C(/C(=C/c1cccc(c1)OC)S2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0201 |
| logD: | 5.02 |
| logSw: | -4.5916 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.778 |
| InChI Key: | SDXDREUWZAQKLS-NRFANRHFSA-N |