2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-3-oxo-N-[3-(pyrrolidin-1-yl)propyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-3-oxo-N-[3-(pyrrolidin-1-yl)propyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-3-oxo-N-[3-(pyrrolidin-1-yl)propyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C310-2439 |
| Compound Name: | 2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-3-oxo-N-[3-(pyrrolidin-1-yl)propyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 481.61 |
| Molecular Formula: | C26 H31 N3 O4 S |
| Smiles: | CN1C(/C(=C/c2ccc(c(c2)OC)OC)Sc2ccc(cc12)C(NCCCN1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8963 |
| logD: | -0.1362 |
| logSw: | -3.4676 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.971 |
| InChI Key: | UOBCBHWURUVRCT-UHFFFAOYSA-N |