6-benzyl-1-ethyl-4-[(4-fluorophenyl)methyl]-3-methyl-1H-pyrazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione
Chemical Structure Depiction of
6-benzyl-1-ethyl-4-[(4-fluorophenyl)methyl]-3-methyl-1H-pyrazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione
6-benzyl-1-ethyl-4-[(4-fluorophenyl)methyl]-3-methyl-1H-pyrazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione
Compound characteristics
| Compound ID: | E961-0990 |
| Compound Name: | 6-benzyl-1-ethyl-4-[(4-fluorophenyl)methyl]-3-methyl-1H-pyrazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione |
| Molecular Weight: | 392.43 |
| Molecular Formula: | C22 H21 F N4 O2 |
| Smiles: | CCn1c2C(N(Cc3ccccc3)C(N(Cc3ccc(cc3)F)c2c(C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5438 |
| logD: | 3.5438 |
| logSw: | -3.5349 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.343 |
| InChI Key: | MXQIGBJOVICWND-UHFFFAOYSA-N |