9-cyclohexyl-3-(3-hydroxypropyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Chemical Structure Depiction of
9-cyclohexyl-3-(3-hydroxypropyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
9-cyclohexyl-3-(3-hydroxypropyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D389-0857 |
| Compound Name: | 9-cyclohexyl-3-(3-hydroxypropyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione |
| Molecular Weight: | 361.44 |
| Molecular Formula: | C18 H27 N5 O3 |
| Smiles: | CN1C(N(CCCO)C(c2c1nc1N(CCCn12)C1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0251 |
| logD: | 2.025 |
| logSw: | -1.9277 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.521 |
| InChI Key: | IKAFZYYJVSMPJU-UHFFFAOYSA-N |