2-[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-[(oxolan-2-yl)methyl]acetamide
2-[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C656-0502 |
| Compound Name: | 2-[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-[(oxolan-2-yl)methyl]acetamide |
| Molecular Weight: | 388.81 |
| Molecular Formula: | C17 H17 Cl N6 O3 |
| Smiles: | C1CC(CNC(CN2C=Nc3c(C2=O)nnn3c2cccc(c2)[Cl])=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.561 |
| logD: | 0.561 |
| logSw: | -2.5456 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.284 |
| InChI Key: | GLFSHWRNQSTXFY-CYBMUJFWSA-N |