2-[(2,4-dimethylanilino)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-dimethylanilino)methyl]-4,5,6,7-tetrahydro-8H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-one
2-[(2,4-dimethylanilino)methyl]-4,5,6,7-tetrahydro-8H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-one
Compound characteristics
| Compound ID: | D433-1836 |
| Compound Name: | 2-[(2,4-dimethylanilino)methyl]-4,5,6,7-tetrahydro-8H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin-8-one |
| Molecular Weight: | 309.37 |
| Molecular Formula: | C17 H19 N5 O |
| Smiles: | Cc1ccc(c(C)c1)NCc1nc2NC3CCCC=3C(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5897 |
| logD: | 1.5077 |
| logSw: | -2.8401 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.736 |
| InChI Key: | PYUURVNGFUTUCA-UHFFFAOYSA-N |