1-(2,3-dihydro-4H-1,4-benzothiazin-4-yl)-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butane-1,4-dione
Chemical Structure Depiction of
1-(2,3-dihydro-4H-1,4-benzothiazin-4-yl)-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butane-1,4-dione
1-(2,3-dihydro-4H-1,4-benzothiazin-4-yl)-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butane-1,4-dione
Compound characteristics
| Compound ID: | E539-0019 |
| Compound Name: | 1-(2,3-dihydro-4H-1,4-benzothiazin-4-yl)-4-[4-(2,3-dimethylphenyl)piperazin-1-yl]butane-1,4-dione |
| Molecular Weight: | 423.58 |
| Molecular Formula: | C24 H29 N3 O2 S |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C(CCC(N1CCSc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8168 |
| logD: | 3.8168 |
| logSw: | -3.8572 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.376 |
| InChI Key: | KZDPHQINVHKAOJ-UHFFFAOYSA-N |