N-{3-[bis(2-methylpropyl)amino]propyl}-2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
Chemical Structure Depiction of
N-{3-[bis(2-methylpropyl)amino]propyl}-2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
N-{3-[bis(2-methylpropyl)amino]propyl}-2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
Compound characteristics
| Compound ID: | K788-1427 |
| Compound Name: | N-{3-[bis(2-methylpropyl)amino]propyl}-2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide |
| Molecular Weight: | 514.13 |
| Molecular Formula: | C28 H36 Cl N3 O2 S |
| Smiles: | CC(C)CN(CCCNC(CN1C(/C(=C/c2cccc(c2)[Cl])Sc2ccccc12)=O)=O)CC(C)C |
| Stereo: | ACHIRAL |
| logP: | 5.9827 |
| logD: | 3.1292 |
| logSw: | -5.9011 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.616 |
| InChI Key: | QOXFCQJOSDCDCG-UHFFFAOYSA-N |