6-[(4-fluorophenyl)methyl]-3-(3-methoxyphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Chemical Structure Depiction of
6-[(4-fluorophenyl)methyl]-3-(3-methoxyphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
6-[(4-fluorophenyl)methyl]-3-(3-methoxyphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Compound characteristics
Compound ID: | C656-0592 |
Compound Name: | 6-[(4-fluorophenyl)methyl]-3-(3-methoxyphenyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
Molecular Weight: | 351.34 |
Molecular Formula: | C18 H14 F N5 O2 |
Smiles: | COc1cccc(c1)n1c2c(C(N(Cc3ccc(cc3)F)C=N2)=O)nn1 |
Stereo: | ACHIRAL |
logP: | 2.318 |
logD: | 2.318 |
logSw: | -2.6649 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 60.702 |
InChI Key: | GNYABQSVXARFBD-UHFFFAOYSA-N |