3-(1,3-benzothiazol-2-yl)-N-[(1-methyl-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-methyl-2-oxo-1,3,4,5,6,7-hexahydroquinolin-4a(2H)-yl)methyl]propanamide
3-(1,3-benzothiazol-2-yl)-N-[(1-methyl-2-oxo-1,3,4,5,6,7-hexahydroquinolin-4a(2H)-yl)methyl]propanamide
Compound characteristics
| Compound ID: | S570-0195 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-N-[(1-methyl-2-oxo-1,3,4,5,6,7-hexahydroquinolin-4a(2H)-yl)methyl]propanamide |
| Molecular Weight: | 383.51 |
| Molecular Formula: | C21 H25 N3 O2 S |
| Smiles: | CN1C2=CCCCC2(CCC1=O)CNC(CCc1nc2ccccc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2831 |
| logD: | 3.2831 |
| logSw: | -3.5482 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.083 |
| InChI Key: | RNFIPAJSVDWYSO-NRFANRHFSA-N |