3-(4-fluorophenyl)-6-methyl-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-(4-fluorophenyl)-6-methyl-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
3-(4-fluorophenyl)-6-methyl-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C280-1057 |
| Compound Name: | 3-(4-fluorophenyl)-6-methyl-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 405.51 |
| Molecular Formula: | C19 H20 F N3 O2 S2 |
| Smiles: | CC1CC2=C(C(N(C(=N2)SCC(N2CCCC2)=O)c2ccc(cc2)F)=O)S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7387 |
| logD: | 2.7386 |
| logSw: | -2.9812 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 42.255 |
| InChI Key: | NMRNCAAPSVJJNV-LBPRGKRZSA-N |