6-(4-methylbenzene-1-sulfonyl)-N-{[4-(methylsulfanyl)phenyl]methyl}pyridine-3-carboxamide
Chemical Structure Depiction of
6-(4-methylbenzene-1-sulfonyl)-N-{[4-(methylsulfanyl)phenyl]methyl}pyridine-3-carboxamide
6-(4-methylbenzene-1-sulfonyl)-N-{[4-(methylsulfanyl)phenyl]methyl}pyridine-3-carboxamide
Compound characteristics
| Compound ID: | C201-0999 |
| Compound Name: | 6-(4-methylbenzene-1-sulfonyl)-N-{[4-(methylsulfanyl)phenyl]methyl}pyridine-3-carboxamide |
| Molecular Weight: | 412.53 |
| Molecular Formula: | C21 H20 N2 O3 S2 |
| Smiles: | Cc1ccc(cc1)S(c1ccc(cn1)C(NCc1ccc(cc1)SC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1838 |
| logD: | 4.1836 |
| logSw: | -4.0422 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.065 |
| InChI Key: | ZBGJBTBFICLZJS-UHFFFAOYSA-N |