ethyl 5-{[3-(3,5-dimethyl-1H-pyrazol-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-5-yl]methyl}-1,2-oxazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-{[3-(3,5-dimethyl-1H-pyrazol-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-5-yl]methyl}-1,2-oxazole-3-carboxylate
ethyl 5-{[3-(3,5-dimethyl-1H-pyrazol-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-5-yl]methyl}-1,2-oxazole-3-carboxylate
Compound characteristics
| Compound ID: | D699-0114 |
| Compound Name: | ethyl 5-{[3-(3,5-dimethyl-1H-pyrazol-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-5-yl]methyl}-1,2-oxazole-3-carboxylate |
| Molecular Weight: | 417.43 |
| Molecular Formula: | C21 H19 N7 O3 |
| Smiles: | CCOC(c1cc(Cn2c3ccccc3c3c2nc(nn3)n2c(C)cc(C)n2)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9106 |
| logD: | 2.9101 |
| logSw: | -2.936 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 88.786 |
| InChI Key: | LJVPJWQXRZNNAI-UHFFFAOYSA-N |