1-methyl-9-(4-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-methyl-9-(4-methylphenyl)-3-(prop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
1-methyl-9-(4-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: | D389-0067 |
| Compound Name: | 1-methyl-9-(4-methylphenyl)-3-(prop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 351.41 |
| Molecular Formula: | C19 H21 N5 O2 |
| Smiles: | Cc1ccc(cc1)N1CCCn2c3C(N(CC=C)C(N(C)c3nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2569 |
| logD: | 3.2566 |
| logSw: | -3.1311 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.033 |
| InChI Key: | LIVDLJZEZYHQSU-UHFFFAOYSA-N |