3-(4-fluorophenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(4-fluorophenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
3-(4-fluorophenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | G858-0483 |
| Compound Name: | 3-(4-fluorophenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one |
| Molecular Weight: | 503.6 |
| Molecular Formula: | C28 H26 F N3 O3 S |
| Smiles: | COc1cccc(CSC2=Nc3cc(ccc3C(N2c2ccc(cc2)F)=O)C(N2CCCCC2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.4098 |
| logD: | 4.4096 |
| logSw: | -4.2954 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.352 |
| InChI Key: | BHVGTLBEMWMQJJ-UHFFFAOYSA-N |