2-[(2,4-dimethoxyanilino)methyl]-4,5,6,7-tetrahydro-8H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-one
Chemical Structure Depiction of
2-[(2,4-dimethoxyanilino)methyl]-4,5,6,7-tetrahydro-8H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-one
2-[(2,4-dimethoxyanilino)methyl]-4,5,6,7-tetrahydro-8H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-one
Compound characteristics
| Compound ID: | D433-1838 |
| Compound Name: | 2-[(2,4-dimethoxyanilino)methyl]-4,5,6,7-tetrahydro-8H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-one |
| Molecular Weight: | 341.37 |
| Molecular Formula: | C17 H19 N5 O3 |
| Smiles: | COc1ccc(c(c1)OC)NCc1nc2NC3CCCC=3C(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6438 |
| logD: | 0.5618 |
| logSw: | -2.1786 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.91 |
| InChI Key: | RMSNWZMUFOKBJR-UHFFFAOYSA-N |