7,8-dimethyl-3-[2-(morpholin-4-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Chemical Structure Depiction of
7,8-dimethyl-3-[2-(morpholin-4-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
7,8-dimethyl-3-[2-(morpholin-4-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Compound characteristics
| Compound ID: | Y020-9007 |
| Compound Name: | 7,8-dimethyl-3-[2-(morpholin-4-yl)ethyl]-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one |
| Molecular Weight: | 437.46 |
| Molecular Formula: | C21 H26 F3 N5 O2 |
| Smiles: | CC1=C(C)N=C2N(CN(CCN3CCOCC3)CN2c2cccc(c2)C(F)(F)F)C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.4877 |
| logD: | 1.4915 |
| logSw: | -2.5483 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.02 |
| InChI Key: | CDBBKBXHEHRITC-UHFFFAOYSA-N |