9-(2,3-dimethylphenyl)-1-methyl-3-[2-(piperidin-1-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Chemical Structure Depiction of
9-(2,3-dimethylphenyl)-1-methyl-3-[2-(piperidin-1-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-(2,3-dimethylphenyl)-1-methyl-3-[2-(piperidin-1-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D389-1120 |
| Compound Name: | 9-(2,3-dimethylphenyl)-1-methyl-3-[2-(piperidin-1-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 436.56 |
| Molecular Formula: | C24 H32 N6 O2 |
| Smiles: | Cc1cccc(c1C)N1CCCn2c3C(N(CCN4CCCCC4)C(N(C)c3nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9754 |
| logD: | 1.8225 |
| logSw: | -3.9336 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.443 |
| InChI Key: | NNVFRJHMZZEJHA-UHFFFAOYSA-N |