7-[(2-fluorophenyl)methyl]-3-phenyl-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(2-fluorophenyl)methyl]-3-phenyl-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
7-[(2-fluorophenyl)methyl]-3-phenyl-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V023-8225 |
| Compound Name: | 7-[(2-fluorophenyl)methyl]-3-phenyl-1-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 376.39 |
| Molecular Formula: | C21 H17 F N4 O2 |
| Smiles: | C=CCN1C(c2c(ncn2Cc2ccccc2F)N(C1=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0182 |
| logD: | 3.0182 |
| logSw: | -3.0414 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.524 |
| InChI Key: | YNEFWHVHEHWILP-UHFFFAOYSA-N |