2-[(2-chlorophenyl)methylidene]-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
2-[(2-chlorophenyl)methylidene]-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
2-[(2-chlorophenyl)methylidene]-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | K788-9590 |
| Compound Name: | 2-[(2-chlorophenyl)methylidene]-N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 518.08 |
| Molecular Formula: | C29 H28 Cl N3 O2 S |
| Smiles: | CN1C(/C(=C\c2ccccc2[Cl])Sc2ccc(cc12)C(NCCCN1CCc2ccccc2C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2059 |
| logD: | 4.0561 |
| logSw: | -5.6321 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.006 |
| InChI Key: | WFWDMEBQFJJIFG-UHFFFAOYSA-N |