2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | G859-0032 |
| Compound Name: | 2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one |
| Molecular Weight: | 501.62 |
| Molecular Formula: | C29 H28 F N3 O2 S |
| Smiles: | Cc1ccc(C)c(CSC2=Nc3cc(ccc3C(N2c2cccc(c2)F)=O)C(N2CCCCC2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.6283 |
| logD: | 5.6278 |
| logSw: | -5.2383 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.808 |
| InChI Key: | ZATCTWGRGZTPOG-UHFFFAOYSA-N |