1,7-dimethyl-9-(3-methylphenyl)-3-(prop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1,7-dimethyl-9-(3-methylphenyl)-3-(prop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
1,7-dimethyl-9-(3-methylphenyl)-3-(prop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D389-0685 |
| Compound Name: | 1,7-dimethyl-9-(3-methylphenyl)-3-(prop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 365.43 |
| Molecular Formula: | C20 H23 N5 O2 |
| Smiles: | CC1CN(c2cccc(C)c2)c2nc3c(C(N(CC=C)C(N3C)=O)=O)n2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.772 |
| logD: | 3.7714 |
| logSw: | -3.8019 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.9 |
| InChI Key: | ADDLJDFMFJLSJT-AWEZNQCLSA-N |