2-{2-[(2-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
Chemical Structure Depiction of
2-{2-[(2-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
2-{2-[(2-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
Compound characteristics
| Compound ID: | C312-0461 |
| Compound Name: | 2-{2-[(2-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide |
| Molecular Weight: | 453.53 |
| Molecular Formula: | C24 H24 F N3 O3 S |
| Smiles: | C1CC(N(C1)CCCNC(CN1C(/C(=C/c2ccccc2F)Sc2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4894 |
| logD: | 2.4894 |
| logSw: | -2.8132 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.895 |
| InChI Key: | KHOJVSWFRBWABJ-UHFFFAOYSA-N |