N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-5-[(2,3,5,6-tetrafluorophenoxy)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-5-[(2,3,5,6-tetrafluorophenoxy)methyl]furan-2-carboxamide
N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-5-[(2,3,5,6-tetrafluorophenoxy)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | Y502-1015 |
| Compound Name: | N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-5-[(2,3,5,6-tetrafluorophenoxy)methyl]furan-2-carboxamide |
| Molecular Weight: | 521.49 |
| Molecular Formula: | C24 H19 F4 N3 O4 S |
| Smiles: | CC1CCc2c3C(N(C(C)=Nc3sc2C1)NC(c1ccc(COc2c(c(cc(c2F)F)F)F)o1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8689 |
| logD: | 4.8685 |
| logSw: | -4.8084 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.852 |
| InChI Key: | JBADGIWLULKYDI-SNVBAGLBSA-N |