2-[(3-bromo-4-methoxyphenyl)methylidene]-4-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-[(3-bromo-4-methoxyphenyl)methylidene]-4-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-2H-1,4-benzothiazin-3(4H)-one
2-[(3-bromo-4-methoxyphenyl)methylidene]-4-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | K788-5834 |
| Compound Name: | 2-[(3-bromo-4-methoxyphenyl)methylidene]-4-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 598.95 |
| Molecular Formula: | C28 H25 Br Cl N3 O3 S |
| Smiles: | COc1ccc(\C=C2/C(N(CC(N3CCN(CC3)c3cccc(c3)[Cl])=O)c3ccccc3S2)=O)cc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.553 |
| logD: | 5.553 |
| logSw: | -5.9038 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.353 |
| InChI Key: | RTZLECKZBBMJGA-UHFFFAOYSA-N |