2-[(4-ethylphenyl)methylidene]-4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
2-[(4-ethylphenyl)methylidene]-4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2H-1,4-benzothiazin-3(4H)-one
2-[(4-ethylphenyl)methylidene]-4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C312-1776 |
| Compound Name: | 2-[(4-ethylphenyl)methylidene]-4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 392.52 |
| Molecular Formula: | C23 H24 N2 O2 S |
| Smiles: | CCc1ccc(\C=C2/C(N(CC(N3CCCC3)=O)c3ccccc3S2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6908 |
| logD: | 4.6908 |
| logSw: | -4.2642 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.828 |
| InChI Key: | LRPQHGRBEJJHNC-UHFFFAOYSA-N |