6-[2-(piperidin-1-yl)ethyl]-1-(prop-2-en-1-yl)-4-[4-(trifluoromethyl)phenyl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Chemical Structure Depiction of
6-[2-(piperidin-1-yl)ethyl]-1-(prop-2-en-1-yl)-4-[4-(trifluoromethyl)phenyl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
6-[2-(piperidin-1-yl)ethyl]-1-(prop-2-en-1-yl)-4-[4-(trifluoromethyl)phenyl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Compound characteristics
| Compound ID: | V013-7505 |
| Compound Name: | 6-[2-(piperidin-1-yl)ethyl]-1-(prop-2-en-1-yl)-4-[4-(trifluoromethyl)phenyl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione |
| Molecular Weight: | 448.49 |
| Molecular Formula: | C23 H27 F3 N4 O2 |
| Salt: | not_available |
| Smiles: | C=CCN1C2CN(CCN3CCCCC3)C(C=2C(c2ccc(cc2)C(F)(F)F)NC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1195 |
| logD: | 0.7279 |
| logSw: | -3.248 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.676 |
| InChI Key: | AJXKCEWLUXCMOP-HXUWFJFHSA-N |