4-chloro-N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-1,3-dimethyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
4-chloro-N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-1,3-dimethyl-1H-pyrazole-5-carboxamide
4-chloro-N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-1,3-dimethyl-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y500-2998 |
| Compound Name: | 4-chloro-N-(2,7-dimethyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-1,3-dimethyl-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 405.9 |
| Molecular Formula: | C18 H20 Cl N5 O2 S |
| Smiles: | CC1CCc2c3C(N(C(C)=Nc3sc2C1)NC(c1c(c(C)nn1C)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1895 |
| logD: | 2.1772 |
| logSw: | -3.7383 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.479 |
| InChI Key: | FLUZYYSFUCVJLK-MRVPVSSYSA-N |