2-{2-[(3-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-{2-[(3-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
2-{2-[(3-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | C312-0119 |
| Compound Name: | 2-{2-[(3-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide |
| Molecular Weight: | 497.45 |
| Molecular Formula: | C25 H25 Br N2 O2 S |
| Smiles: | C1CCC(CCNC(CN2C(/C(=C\c3cccc(c3)[Br])Sc3ccccc23)=O)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.5559 |
| logD: | 5.5559 |
| logSw: | -5.701 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.575 |
| InChI Key: | GVCGRLULOYBULG-UHFFFAOYSA-N |