butyl 4-[(3-ethyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)amino]benzoate
Chemical Structure Depiction of
butyl 4-[(3-ethyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)amino]benzoate
butyl 4-[(3-ethyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)amino]benzoate
Compound characteristics
| Compound ID: | G857-2375 |
| Compound Name: | butyl 4-[(3-ethyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)amino]benzoate |
| Molecular Weight: | 340.38 |
| Molecular Formula: | C17 H20 N6 O2 |
| Smiles: | CCCCOC(c1ccc(cc1)Nc1c2c(ncn1)n(CC)nn2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3493 |
| logD: | 3.3493 |
| logSw: | -3.4351 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.7 |
| InChI Key: | ZIFUYLMXSSZHGO-UHFFFAOYSA-N |