1-cyclopropyl-7-(3,3-dimethyl-2-oxobutyl)-3-(4-fluorophenyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-cyclopropyl-7-(3,3-dimethyl-2-oxobutyl)-3-(4-fluorophenyl)-3,7-dihydro-1H-purine-2,6-dione
1-cyclopropyl-7-(3,3-dimethyl-2-oxobutyl)-3-(4-fluorophenyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-5904 |
| Compound Name: | 1-cyclopropyl-7-(3,3-dimethyl-2-oxobutyl)-3-(4-fluorophenyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 384.41 |
| Molecular Formula: | C20 H21 F N4 O3 |
| Smiles: | CC(C)(C)C(Cn1cnc2c1C(N(C1CC1)C(N2c1ccc(cc1)F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3174 |
| logD: | 2.3174 |
| logSw: | -2.5421 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.346 |
| InChI Key: | AAXSUKMREPIETM-UHFFFAOYSA-N |