N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxo-5,6,7,8-tetrahydroquinazolin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxo-5,6,7,8-tetrahydroquinazolin-3(4H)-yl]acetamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxo-5,6,7,8-tetrahydroquinazolin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | G953-0338 |
| Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxo-5,6,7,8-tetrahydroquinazolin-3(4H)-yl]acetamide |
| Molecular Weight: | 479.89 |
| Molecular Formula: | C22 H21 Cl F3 N5 O2 |
| Smiles: | Cc1cc(C)n(C2=NC3CCCCC=3C(N2CC(Nc2cc(ccc2[Cl])C(F)(F)F)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.2447 |
| logD: | 3.2228 |
| logSw: | -3.6166 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.664 |
| InChI Key: | MHKCOWOKZQBCQB-UHFFFAOYSA-N |