5-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-7-(3-fluorophenyl)-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
5-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-7-(3-fluorophenyl)-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
5-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-7-(3-fluorophenyl)-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | G786-1873 |
| Compound Name: | 5-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-7-(3-fluorophenyl)-1,3-dimethylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 477.52 |
| Molecular Formula: | C24 H20 F N5 O3 S |
| Smiles: | CN1C(c2c(nc(c3cccc(c3)F)nc2SCC(N2CCc3ccccc23)=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7728 |
| logD: | 4.7728 |
| logSw: | -4.6455 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.207 |
| InChI Key: | OLFSROGQSBYHKK-UHFFFAOYSA-N |