1-benzyl-2-ethyl-7,7-dimethyl-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one
Chemical Structure Depiction of
1-benzyl-2-ethyl-7,7-dimethyl-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one
1-benzyl-2-ethyl-7,7-dimethyl-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one
Compound characteristics
Compound ID: | 7591-0714 |
Compound Name: | 1-benzyl-2-ethyl-7,7-dimethyl-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one |
Molecular Weight: | 432.41 |
Molecular Formula: | C21 H22 F6 N2 O |
Smiles: | CCC1=NC(C2=C(CC(C)(C)CC2=O)N1Cc1ccccc1)(C(F)(F)F)C(F)(F)F |
Stereo: | ACHIRAL |
logP: | 5.2901 |
logD: | 5.2901 |
logSw: | -5.2167 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 26.5469 |
InChI Key: | CVNSDCUVIPKMIJ-UHFFFAOYSA-N |