1-benzyl-7,7-dimethyl-2-(2-phenylethyl)-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one
Chemical Structure Depiction of
1-benzyl-7,7-dimethyl-2-(2-phenylethyl)-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one
1-benzyl-7,7-dimethyl-2-(2-phenylethyl)-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one
Compound characteristics
| Compound ID: | 7591-0931 |
| Compound Name: | 1-benzyl-7,7-dimethyl-2-(2-phenylethyl)-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one |
| Molecular Weight: | 508.51 |
| Molecular Formula: | C27 H26 F6 N2 O |
| Smiles: | CC1(C)CC2=C(C(C1)=O)C(C(F)(F)F)(C(F)(F)F)N=C(CCc1ccccc1)N2Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.852 |
| logD: | 6.8519 |
| logSw: | -5.7832 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 26.2753 |
| InChI Key: | KMKQHNQQTOTUIQ-UHFFFAOYSA-N |