pyrimido[4,5-e][1,2,4]triazine-3,6,8(2H,5H,7H)-trione
Chemical Structure Depiction of
pyrimido[4,5-e][1,2,4]triazine-3,6,8(2H,5H,7H)-trione
pyrimido[4,5-e][1,2,4]triazine-3,6,8(2H,5H,7H)-trione
Compound characteristics
| Compound ID: | 8017-1885 |
| Compound Name: | pyrimido[4,5-e][1,2,4]triazine-3,6,8(2H,5H,7H)-trione |
| Molecular Weight: | 181.11 |
| Molecular Formula: | C5 H3 N5 O3 |
| Smiles: | C12C(NC(NC1=O)=O)=NC(NN=2)=O |
| Stereo: | ACHIRAL |
| logP: | -1.5103 |
| logD: | -3.7143 |
| logSw: | -1.3659 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.157 |
| InChI Key: | MZWNCGFJUDIDKU-UHFFFAOYSA-N |