6-{4-[chloro(difluoro)methoxy]phenyl}-4-(4-hydroxyphenyl)-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Chemical Structure Depiction of
6-{4-[chloro(difluoro)methoxy]phenyl}-4-(4-hydroxyphenyl)-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
6-{4-[chloro(difluoro)methoxy]phenyl}-4-(4-hydroxyphenyl)-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Compound characteristics
| Compound ID: | 8017-1219 |
| Compound Name: | 6-{4-[chloro(difluoro)methoxy]phenyl}-4-(4-hydroxyphenyl)-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione |
| Molecular Weight: | 435.81 |
| Molecular Formula: | C20 H16 Cl F2 N3 O4 |
| Smiles: | CN1C2CN(C(C=2C(c2ccc(cc2)O)NC1=O)=O)c1ccc(cc1)OC(F)(F)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7629 |
| logD: | 2.7305 |
| logSw: | -3.5508 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.171 |
| InChI Key: | IWQYKCPWYLSARW-QGZVFWFLSA-N |