2-(benzylamino)-5-methyl-6-[3-(morpholin-4-yl)-3-oxopropyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-(benzylamino)-5-methyl-6-[3-(morpholin-4-yl)-3-oxopropyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-(benzylamino)-5-methyl-6-[3-(morpholin-4-yl)-3-oxopropyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D481-0007 |
| Compound Name: | 2-(benzylamino)-5-methyl-6-[3-(morpholin-4-yl)-3-oxopropyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 396.45 |
| Molecular Formula: | C20 H24 N6 O3 |
| Smiles: | CC1=C(CCC(N2CCOCC2)=O)C(n2c(N1)nc(NCc1ccccc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8881 |
| logD: | 0.8449 |
| logSw: | -1.7269 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.921 |
| InChI Key: | ISMBRSHVZULFAA-UHFFFAOYSA-N |