N-(2-{[(2,6-dichlorophenyl)methyl]sulfanyl}ethyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide
Chemical Structure Depiction of
N-(2-{[(2,6-dichlorophenyl)methyl]sulfanyl}ethyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide
N-(2-{[(2,6-dichlorophenyl)methyl]sulfanyl}ethyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | V008-3890 |
| Compound Name: | N-(2-{[(2,6-dichlorophenyl)methyl]sulfanyl}ethyl)-2-(4-ethoxyphenyl)quinoline-4-carboxamide |
| Molecular Weight: | 511.47 |
| Molecular Formula: | C27 H24 Cl2 N2 O2 S |
| Salt: | not_available |
| Smiles: | CCOc1ccc(cc1)c1cc(C(NCCSCc2c(cccc2[Cl])[Cl])=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 7.7722 |
| logD: | 7.7722 |
| logSw: | -6.3837 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.676 |
| InChI Key: | PNFDCQBUFKVHAP-UHFFFAOYSA-N |