1-(2-hydroxyethyl)-4,7,9-trimethyl-3-phenyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Chemical Structure Depiction of
1-(2-hydroxyethyl)-4,7,9-trimethyl-3-phenyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
1-(2-hydroxyethyl)-4,7,9-trimethyl-3-phenyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Compound characteristics
| Compound ID: | 8016-8087 |
| Compound Name: | 1-(2-hydroxyethyl)-4,7,9-trimethyl-3-phenyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione |
| Molecular Weight: | 368.39 |
| Molecular Formula: | C18 H20 N6 O3 |
| Smiles: | CC1C(c2ccccc2)=NN(CCO)c2nc3c(C(N(C)C(N3C)=O)=O)n12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0897 |
| logD: | 2.0892 |
| logSw: | -2.3094 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.195 |
| InChI Key: | STJNAIAVQZCCIQ-NSHDSACASA-N |