4-[(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)methyl]-N-({1-[(2-fluorophenyl)methyl]piperidin-4-yl}methyl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-[(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)methyl]-N-({1-[(2-fluorophenyl)methyl]piperidin-4-yl}methyl)cyclohexane-1-carboxamide
4-[(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)methyl]-N-({1-[(2-fluorophenyl)methyl]piperidin-4-yl}methyl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | C200-5438 |
| Compound Name: | 4-[(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)methyl]-N-({1-[(2-fluorophenyl)methyl]piperidin-4-yl}methyl)cyclohexane-1-carboxamide |
| Molecular Weight: | 512.65 |
| Molecular Formula: | C27 H33 F N4 O3 S |
| Smiles: | C1CC(CCC1CN1C(c2c(ccs2)NC1=O)=O)C(NCC1CCN(CC1)Cc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7248 |
| logD: | 2.9354 |
| logSw: | -4.6284 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.837 |
| InChI Key: | BBSVGVKFZUXZHE-UHFFFAOYSA-N |