N-[3-(morpholin-4-yl)propyl]-3-(pyrimidin-2-yl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
N-[3-(morpholin-4-yl)propyl]-3-(pyrimidin-2-yl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
N-[3-(morpholin-4-yl)propyl]-3-(pyrimidin-2-yl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V009-2086 |
| Compound Name: | N-[3-(morpholin-4-yl)propyl]-3-(pyrimidin-2-yl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 504.56 |
| Molecular Formula: | C25 H31 F3 N6 O2 |
| Salt: | not_available |
| Smiles: | C(CNC(C1Cc2cc(ccc2N2CCN(CC12)c1ncccn1)C(F)(F)F)=O)CN1CCOCC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6456 |
| logD: | 2.2221 |
| logSw: | -3.1276 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.312 |
| InChI Key: | CPYRVTMKQBVJDQ-UHFFFAOYSA-N |