9-(3-chloro-4-methylphenyl)-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-(3-chloro-4-methylphenyl)-1-methyl-3-[2-(morpholin-4-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-(3-chloro-4-methylphenyl)-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: | D389-1039 |
| Compound Name: | 9-(3-chloro-4-methylphenyl)-1-methyl-3-[2-(morpholin-4-yl)ethyl]-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 458.95 |
| Molecular Formula: | C22 H27 Cl N6 O3 |
| Smiles: | Cc1ccc(cc1[Cl])N1CCCn2c3C(N(CCN4CCOCC4)C(N(C)c3nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.206 |
| logD: | 3.0247 |
| logSw: | -3.3398 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.652 |
| InChI Key: | BFQLUYJMBYELEF-UHFFFAOYSA-N |