N-(3,5-dimethoxyphenyl)-3-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanamide
Chemical Structure Depiction of
N-(3,5-dimethoxyphenyl)-3-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanamide
N-(3,5-dimethoxyphenyl)-3-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanamide
Compound characteristics
Compound ID: | F145-0197 |
Compound Name: | N-(3,5-dimethoxyphenyl)-3-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanamide |
Molecular Weight: | 413.49 |
Molecular Formula: | C21 H23 N3 O4 S |
Smiles: | COc1cc(cc(c1)OC)NC(CCC1NC(c2c3CCCCc3sc2N=1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.3447 |
logD: | 3.3441 |
logSw: | -3.8225 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.96 |
InChI Key: | JPFBUAYIQRYPPP-UHFFFAOYSA-N |