7-ethyl-1-(4-fluorophenyl)-8-methyl-3-[(pyridin-3-yl)methyl]-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Chemical Structure Depiction of
7-ethyl-1-(4-fluorophenyl)-8-methyl-3-[(pyridin-3-yl)methyl]-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
7-ethyl-1-(4-fluorophenyl)-8-methyl-3-[(pyridin-3-yl)methyl]-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Compound characteristics
| Compound ID: | Y020-3786 |
| Compound Name: | 7-ethyl-1-(4-fluorophenyl)-8-methyl-3-[(pyridin-3-yl)methyl]-1,2,3,4-tetrahydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one |
| Molecular Weight: | 379.44 |
| Molecular Formula: | C21 H22 F N5 O |
| Smiles: | CCC1=C(C)N=C2N(CN(Cc3cccnc3)CN2c2ccc(cc2)F)C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.6953 |
| logD: | 2.6893 |
| logSw: | -2.2428 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.668 |
| InChI Key: | NZUBZNDMWHNGKW-UHFFFAOYSA-N |