9-(4-bromophenyl)-1-methyl-3-(2-oxopropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Chemical Structure Depiction of
9-(4-bromophenyl)-1-methyl-3-(2-oxopropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-(4-bromophenyl)-1-methyl-3-(2-oxopropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 8174-1347 |
| Compound Name: | 9-(4-bromophenyl)-1-methyl-3-(2-oxopropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 432.27 |
| Molecular Formula: | C18 H18 Br N5 O3 |
| Smiles: | CC(CN1C(c2c(nc3N(CCCn23)c2ccc(cc2)[Br])N(C)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6254 |
| logD: | 2.6251 |
| logSw: | -2.7748 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.389 |
| InChI Key: | YZDDXWDZMJHKDD-UHFFFAOYSA-N |