2-(4-chlorophenyl)-7-(3-hydroxypropyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-7-(3-hydroxypropyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
2-(4-chlorophenyl)-7-(3-hydroxypropyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Compound characteristics
| Compound ID: | Y020-4858 |
| Compound Name: | 2-(4-chlorophenyl)-7-(3-hydroxypropyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one |
| Molecular Weight: | 355.78 |
| Molecular Formula: | C17 H14 Cl N5 O2 |
| Smiles: | C(CN1C=CC2=C(C=Nc3nc(c4ccc(cc4)[Cl])nn23)C1=O)CO |
| Stereo: | ACHIRAL |
| logP: | 1.8603 |
| logD: | 1.8603 |
| logSw: | -2.6362 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.443 |
| InChI Key: | MMSNSDCYNJYLGG-UHFFFAOYSA-N |