1-(3,4-difluorobenzoyl)-1'-ethyl-6'-fluoro-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
Chemical Structure Depiction of
1-(3,4-difluorobenzoyl)-1'-ethyl-6'-fluoro-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
1-(3,4-difluorobenzoyl)-1'-ethyl-6'-fluoro-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one
Compound characteristics
| Compound ID: | P500-0648 |
| Compound Name: | 1-(3,4-difluorobenzoyl)-1'-ethyl-6'-fluoro-1'H-spiro[piperidine-4,2'-quinazolin]-4'(3'H)-one |
| Molecular Weight: | 403.4 |
| Molecular Formula: | C21 H20 F3 N3 O2 |
| Smiles: | CCN1c2ccc(cc2C(NC12CCN(CC2)C(c1ccc(c(c1)F)F)=O)=O)F |
| Stereo: | ACHIRAL |
| logP: | 2.7828 |
| logD: | 2.7828 |
| logSw: | -3.4312 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.598 |
| InChI Key: | PABKWECSJZJFCD-UHFFFAOYSA-N |