N-(2-bromophenyl)-1-(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2-bromophenyl)-1-(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)piperidine-4-carboxamide
N-(2-bromophenyl)-1-(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)piperidine-4-carboxamide
Compound characteristics
Compound ID: | C860-0752 |
Compound Name: | N-(2-bromophenyl)-1-(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)piperidine-4-carboxamide |
Molecular Weight: | 485.38 |
Molecular Formula: | C22 H18 Br F N4 O S |
Smiles: | C1CN(CCC1C(Nc1ccccc1[Br])=O)c1c2c(c3c(cccc3s2)F)ncn1 |
Stereo: | ACHIRAL |
logP: | 5.4219 |
logD: | 5.3849 |
logSw: | -5.7058 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.059 |
InChI Key: | GWAMIFUGYSXASU-UHFFFAOYSA-N |