N-[(2-fluorophenyl)methyl]-3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)propanamide
Chemical Structure Depiction of
N-[(2-fluorophenyl)methyl]-3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)propanamide
N-[(2-fluorophenyl)methyl]-3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)propanamide
Compound characteristics
Compound ID: | F145-0978 |
Compound Name: | N-[(2-fluorophenyl)methyl]-3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)propanamide |
Molecular Weight: | 399.49 |
Molecular Formula: | C21 H22 F N3 O2 S |
Smiles: | C1CCc2c3C(NC(CCC(NCc4ccccc4F)=O)=Nc3sc2CC1)=O |
Stereo: | ACHIRAL |
logP: | 3.7762 |
logD: | 3.7756 |
logSw: | -4.3539 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 59.526 |
InChI Key: | WCHJQSRQZMTLGQ-UHFFFAOYSA-N |