2-(6-chloro-7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(6-chloro-7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-1H-isoindole-1,3(2H)-dione
2-(6-chloro-7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-1H-isoindole-1,3(2H)-dione
Compound characteristics
Compound ID: | D205-0258 |
Compound Name: | 2-(6-chloro-7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-1H-isoindole-1,3(2H)-dione |
Molecular Weight: | 329.7 |
Molecular Formula: | C14 H8 Cl N5 O3 |
Smiles: | Cc1c(c(n2c(n1)nc(n2)N1C(c2ccccc2C1=O)=O)O)[Cl] |
Stereo: | ACHIRAL |
logP: | 1.5536 |
logD: | -0.9293 |
logSw: | -2.7766 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 74.376 |
InChI Key: | RKMUIVGQKYVFTE-UHFFFAOYSA-N |