3-(1,3-benzothiazol-2-yl)-N-{[1-(2-methoxyethyl)-2-oxo-1,3,4,5,6,7-hexahydroquinolin-4a(2H)-yl]methyl}propanamide
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-N-{[1-(2-methoxyethyl)-2-oxo-1,3,4,5,6,7-hexahydroquinolin-4a(2H)-yl]methyl}propanamide
3-(1,3-benzothiazol-2-yl)-N-{[1-(2-methoxyethyl)-2-oxo-1,3,4,5,6,7-hexahydroquinolin-4a(2H)-yl]methyl}propanamide
Compound characteristics
| Compound ID: | S570-0512 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-N-{[1-(2-methoxyethyl)-2-oxo-1,3,4,5,6,7-hexahydroquinolin-4a(2H)-yl]methyl}propanamide |
| Molecular Weight: | 427.56 |
| Molecular Formula: | C23 H29 N3 O3 S |
| Smiles: | COCCN1C2=CCCCC2(CCC1=O)CNC(CCc1nc2ccccc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6004 |
| logD: | 3.6004 |
| logSw: | -3.637 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.638 |
| InChI Key: | UXYZPXDBBWGQFN-QHCPKHFHSA-N |