N-{[1-(cyclopropylmethyl)-2-oxo-1,3,4,5,6,7-hexahydroquinolin-4a(2H)-yl]methyl}-3-fluorobenzamide
Chemical Structure Depiction of
N-{[1-(cyclopropylmethyl)-2-oxo-1,3,4,5,6,7-hexahydroquinolin-4a(2H)-yl]methyl}-3-fluorobenzamide
N-{[1-(cyclopropylmethyl)-2-oxo-1,3,4,5,6,7-hexahydroquinolin-4a(2H)-yl]methyl}-3-fluorobenzamide
Compound characteristics
| Compound ID: | S570-0441 |
| Compound Name: | N-{[1-(cyclopropylmethyl)-2-oxo-1,3,4,5,6,7-hexahydroquinolin-4a(2H)-yl]methyl}-3-fluorobenzamide |
| Molecular Weight: | 356.44 |
| Molecular Formula: | C21 H25 F N2 O2 |
| Smiles: | C1CC=C2C(C1)(CCC(N2CC1CC1)=O)CNC(c1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0405 |
| logD: | 4.0392 |
| logSw: | -4.1708 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.566 |
| InChI Key: | IXXLXHOANPDBIE-NRFANRHFSA-N |