1-acetyl-3-(4-methoxyphenyl)-7,9-dimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Chemical Structure Depiction of
1-acetyl-3-(4-methoxyphenyl)-7,9-dimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
1-acetyl-3-(4-methoxyphenyl)-7,9-dimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Compound characteristics
Compound ID: | 8012-3558 |
Compound Name: | 1-acetyl-3-(4-methoxyphenyl)-7,9-dimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione |
Molecular Weight: | 382.38 |
Molecular Formula: | C18 H18 N6 O4 |
Smiles: | CC(N1c2nc3c(C(N(C)C(N3C)=O)=O)n2CC(c2ccc(cc2)OC)=N1)=O |
Stereo: | ACHIRAL |
logP: | 1.8221 |
logD: | 1.8221 |
logSw: | -2.2464 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 76.672 |
InChI Key: | OFYTYDZINZGANL-UHFFFAOYSA-N |