1'-ethyl-6'-fluoro-1-[4-(trifluoromethyl)benzoyl]-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
Chemical Structure Depiction of
1'-ethyl-6'-fluoro-1-[4-(trifluoromethyl)benzoyl]-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
1'-ethyl-6'-fluoro-1-[4-(trifluoromethyl)benzoyl]-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
Compound characteristics
| Compound ID: | P500-0649 |
| Compound Name: | 1'-ethyl-6'-fluoro-1-[4-(trifluoromethyl)benzoyl]-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one |
| Molecular Weight: | 435.42 |
| Molecular Formula: | C22 H21 F4 N3 O2 |
| Smiles: | CCN1c2ccc(cc2C(NC12CCN(CC2)C(c1ccc(cc1)C(F)(F)F)=O)=O)F |
| Stereo: | ACHIRAL |
| logP: | 3.3632 |
| logD: | 3.3632 |
| logSw: | -3.6511 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.598 |
| InChI Key: | DTMDDQOIFANWRJ-UHFFFAOYSA-N |