3-(4-bromophenyl)-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-bromophenyl)-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
3-(4-bromophenyl)-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C280-0386 |
| Compound Name: | 3-(4-bromophenyl)-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 452.39 |
| Molecular Formula: | C18 H18 Br N3 O2 S2 |
| Smiles: | C1CCN(C1)C(CSC1=NC2CCSC=2C(N1c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9164 |
| logD: | 2.916 |
| logSw: | -3.2212 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 42.255 |
| InChI Key: | RDUJMEHKMMYOOI-UHFFFAOYSA-N |