3-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)propanamide
Chemical Structure Depiction of
3-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)propanamide
3-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)propanamide
Compound characteristics
| Compound ID: | Y500-2652 |
| Compound Name: | 3-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)propanamide |
| Molecular Weight: | 478.41 |
| Molecular Formula: | C20 H24 Br N5 O2 S |
| Smiles: | CC1CCc2c3C(N(C(C)=Nc3sc2C1)NC(CCn1c(C)c(c(C)n1)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6582 |
| logD: | 2.658 |
| logSw: | -2.7923 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.928 |
| InChI Key: | WSTOIJZZMANDCB-SNVBAGLBSA-N |