9-(4-bromophenyl)-1-methyl-3-[2-(morpholin-4-yl)ethyl]-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-(morpholin-4-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-(4-bromophenyl)-1-methyl-3-[2-(morpholin-4-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D389-0692 |
| Compound Name: | 9-(4-bromophenyl)-1-methyl-3-[2-(morpholin-4-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 489.37 |
| Molecular Formula: | C21 H25 Br N6 O3 |
| Smiles: | CN1C(N(CCN2CCOCC2)C(c2c1nc1N(CCCn12)c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8101 |
| logD: | 2.6288 |
| logSw: | -2.9394 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.652 |
| InChI Key: | BPSUQIFCLUBEMW-UHFFFAOYSA-N |