3-(benzenesulfonyl)-N-(3-chloro-4-fluorophenyl)-2H-1-benzopyran-2-imine
Chemical Structure Depiction of
3-(benzenesulfonyl)-N-(3-chloro-4-fluorophenyl)-2H-1-benzopyran-2-imine
3-(benzenesulfonyl)-N-(3-chloro-4-fluorophenyl)-2H-1-benzopyran-2-imine
Compound characteristics
| Compound ID: | C585-0038 |
| Compound Name: | 3-(benzenesulfonyl)-N-(3-chloro-4-fluorophenyl)-2H-1-benzopyran-2-imine |
| Molecular Weight: | 413.85 |
| Molecular Formula: | C21 H13 Cl F N O3 S |
| Smiles: | C1=C(/C(=N/c2ccc(c(c2)[Cl])F)Oc2ccccc12)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9181 |
| logD: | 4.9181 |
| logSw: | -5.2521 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.446 |
| InChI Key: | NYDIFKQSWYEXIO-UHFFFAOYSA-N |