2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxo-5,6,7,8-tetrahydroquinazolin-3(4H)-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide
Chemical Structure Depiction of
2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxo-5,6,7,8-tetrahydroquinazolin-3(4H)-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide
2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxo-5,6,7,8-tetrahydroquinazolin-3(4H)-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide
Compound characteristics
| Compound ID: | G953-0304 |
| Compound Name: | 2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxo-5,6,7,8-tetrahydroquinazolin-3(4H)-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide |
| Molecular Weight: | 461.44 |
| Molecular Formula: | C22 H22 F3 N5 O3 |
| Smiles: | Cc1cc(C)n(C2=NC3CCCCC=3C(N2CC(Nc2ccc(cc2)OC(F)(F)F)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.211 |
| logD: | 3.211 |
| logSw: | -3.4894 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.299 |
| InChI Key: | MJOOTFYNTJZKRG-UHFFFAOYSA-N |