3-[4-(propan-2-yl)phenyl]-1-(prop-2-en-1-yl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-[4-(propan-2-yl)phenyl]-1-(prop-2-en-1-yl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione
3-[4-(propan-2-yl)phenyl]-1-(prop-2-en-1-yl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V011-6598 |
| Compound Name: | 3-[4-(propan-2-yl)phenyl]-1-(prop-2-en-1-yl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 352.43 |
| Molecular Formula: | C20 H24 N4 O2 |
| Salt: | not_available |
| Smiles: | CCCn1cnc2c1C(N(CC=C)C(N2c1ccc(cc1)C(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4195 |
| logD: | 3.4195 |
| logSw: | -3.4067 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.774 |
| InChI Key: | JOMYHRDUXOPXNP-UHFFFAOYSA-N |