5-(3-fluoro-4-methylanilino)-7-methyl-2-[2-(morpholin-4-yl)-2-oxoethyl][1,2,4]triazolo[4,3-c]pyrimidin-3(2H)-one
Chemical Structure Depiction of
5-(3-fluoro-4-methylanilino)-7-methyl-2-[2-(morpholin-4-yl)-2-oxoethyl][1,2,4]triazolo[4,3-c]pyrimidin-3(2H)-one
5-(3-fluoro-4-methylanilino)-7-methyl-2-[2-(morpholin-4-yl)-2-oxoethyl][1,2,4]triazolo[4,3-c]pyrimidin-3(2H)-one
Compound characteristics
| Compound ID: | P572-7763 |
| Compound Name: | 5-(3-fluoro-4-methylanilino)-7-methyl-2-[2-(morpholin-4-yl)-2-oxoethyl][1,2,4]triazolo[4,3-c]pyrimidin-3(2H)-one |
| Molecular Weight: | 400.41 |
| Molecular Formula: | C19 H21 F N6 O3 |
| Smiles: | CC1=CC2=NN(CC(N3CCOCC3)=O)C(N2C(Nc2ccc(C)c(c2)F)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5596 |
| logD: | 1.5486 |
| logSw: | -2.217 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.946 |
| InChI Key: | KHQBQZWJKBYFGI-UHFFFAOYSA-N |