7-[(3,4-difluorophenyl)methyl]-3-(3-methoxyphenyl)-1-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(3,4-difluorophenyl)methyl]-3-(3-methoxyphenyl)-1-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
7-[(3,4-difluorophenyl)methyl]-3-(3-methoxyphenyl)-1-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V023-3998 |
| Compound Name: | 7-[(3,4-difluorophenyl)methyl]-3-(3-methoxyphenyl)-1-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 440.45 |
| Molecular Formula: | C23 H22 F2 N4 O3 |
| Salt: | not_available |
| Smiles: | CC(C)CN1C(c2c(ncn2Cc2ccc(c(c2)F)F)N(C1=O)c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9795 |
| logD: | 3.9795 |
| logSw: | -4.1971 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.09 |
| InChI Key: | IYYBVOOFKNQWIP-UHFFFAOYSA-N |