3-butyl-9-(3-methoxyphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-butyl-9-(3-methoxyphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
3-butyl-9-(3-methoxyphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D389-0495 |
| Compound Name: | 3-butyl-9-(3-methoxyphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 397.48 |
| Molecular Formula: | C21 H27 N5 O3 |
| Smiles: | CCCCN1C(c2c(nc3N(CC(C)Cn23)c2cccc(c2)OC)N(C)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.272 |
| logD: | 4.272 |
| logSw: | -4.1459 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.443 |
| InChI Key: | KOMTUAZDGLRCCV-AWEZNQCLSA-N |