2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-3-(2,2-diethoxyethyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-3-(2,2-diethoxyethyl)quinazolin-4(3H)-one
2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-3-(2,2-diethoxyethyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-2810 |
| Compound Name: | 2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-3-(2,2-diethoxyethyl)quinazolin-4(3H)-one |
| Molecular Weight: | 436.93 |
| Molecular Formula: | C21 H22 Cl F N2 O3 S |
| Smiles: | CCOC(CN1C(=Nc2ccccc2C1=O)SCc1c(cccc1[Cl])F)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.23 |
| logD: | 4.23 |
| logSw: | -4.5254 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.697 |
| InChI Key: | WTXBJPPXGGIYPD-UHFFFAOYSA-N |