1',6'-dimethyl-1-[4-(trifluoromethyl)benzoyl]-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
Chemical Structure Depiction of
1',6'-dimethyl-1-[4-(trifluoromethyl)benzoyl]-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
1',6'-dimethyl-1-[4-(trifluoromethyl)benzoyl]-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
Compound characteristics
| Compound ID: | P500-0172 |
| Compound Name: | 1',6'-dimethyl-1-[4-(trifluoromethyl)benzoyl]-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one |
| Molecular Weight: | 417.43 |
| Molecular Formula: | C22 H22 F3 N3 O2 |
| Smiles: | Cc1ccc2c(c1)C(NC1(CCN(CC1)C(c1ccc(cc1)C(F)(F)F)=O)N2C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1083 |
| logD: | 3.1082 |
| logSw: | -3.4751 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.639 |
| InChI Key: | UCONNMRKLSNTIQ-UHFFFAOYSA-N |