3-(3-chlorophenyl)-1-[(2-fluorophenyl)methyl]-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(3-chlorophenyl)-1-[(2-fluorophenyl)methyl]-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
3-(3-chlorophenyl)-1-[(2-fluorophenyl)methyl]-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V028-9443 |
| Compound Name: | 3-(3-chlorophenyl)-1-[(2-fluorophenyl)methyl]-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 410.83 |
| Molecular Formula: | C21 H16 Cl F N4 O2 |
| Smiles: | C=CCn1cnc2c1C(N(Cc1ccccc1F)C(N2c1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7553 |
| logD: | 3.7553 |
| logSw: | -4.0978 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.524 |
| InChI Key: | GFVIABVEIIRVBY-UHFFFAOYSA-N |