9-(2,3-dimethylphenyl)-1-methyl-3-(2-methylprop-2-en-1-yl)-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-methylprop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-(2,3-dimethylphenyl)-1-methyl-3-(2-methylprop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D389-1093 |
| Compound Name: | 9-(2,3-dimethylphenyl)-1-methyl-3-(2-methylprop-2-en-1-yl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 379.46 |
| Molecular Formula: | C21 H25 N5 O2 |
| Smiles: | CC(=C)CN1C(c2c(nc3N(CCCn23)c2cccc(C)c2C)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3322 |
| logD: | 4.3278 |
| logSw: | -4.2438 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.753 |
| InChI Key: | KGMCQIZKPOAREP-UHFFFAOYSA-N |