methyl (1,7-dimethyl-2,4-dioxo-9-phenyl-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl)acetate
Chemical Structure Depiction of
methyl (1,7-dimethyl-2,4-dioxo-9-phenyl-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl)acetate
methyl (1,7-dimethyl-2,4-dioxo-9-phenyl-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl)acetate
Compound characteristics
| Compound ID: | D389-0373 |
| Compound Name: | methyl (1,7-dimethyl-2,4-dioxo-9-phenyl-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl)acetate |
| Molecular Weight: | 383.41 |
| Molecular Formula: | C19 H21 N5 O4 |
| Smiles: | CC1CN(c2ccccc2)c2nc3c(C(N(CC(=O)OC)C(N3C)=O)=O)n2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.192 |
| logD: | 2.1919 |
| logSw: | -2.4444 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.5 |
| InChI Key: | GGXSCSXVAVVZCP-LBPRGKRZSA-N |