1-methyl-9-(4-phenoxyphenyl)-3-(2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-methyl-9-(4-phenoxyphenyl)-3-(2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
1-methyl-9-(4-phenoxyphenyl)-3-(2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D389-0732 |
| Compound Name: | 1-methyl-9-(4-phenoxyphenyl)-3-(2-phenylethyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 493.57 |
| Molecular Formula: | C29 H27 N5 O3 |
| Smiles: | CN1C(N(CCc2ccccc2)C(c2c1nc1N(CCCn12)c1ccc(cc1)Oc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7957 |
| logD: | 5.7956 |
| logSw: | -5.4523 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.509 |
| InChI Key: | PBIWUXQOOZRILV-UHFFFAOYSA-N |