9-(3,5-dimethylphenyl)-1,7-dimethyl-3-(3-phenylpropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Chemical Structure Depiction of
9-(3,5-dimethylphenyl)-1,7-dimethyl-3-(3-phenylpropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-(3,5-dimethylphenyl)-1,7-dimethyl-3-(3-phenylpropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D389-0633 |
| Compound Name: | 9-(3,5-dimethylphenyl)-1,7-dimethyl-3-(3-phenylpropyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 457.58 |
| Molecular Formula: | C27 H31 N5 O2 |
| Smiles: | CC1CN(c2cc(C)cc(C)c2)c2nc3c(C(N(CCCc4ccccc4)C(N3C)=O)=O)n2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0963 |
| logD: | 6.0955 |
| logSw: | -5.3437 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.628 |
| InChI Key: | VQSXFLJQCWEZBU-FQEVSTJZSA-N |