2-[(2-anilino-2-oxoethyl)sulfanyl]-N-butyl-4-(hydroxymethyl)-6-methylpyridine-3-carboxamide
Chemical Structure Depiction of
2-[(2-anilino-2-oxoethyl)sulfanyl]-N-butyl-4-(hydroxymethyl)-6-methylpyridine-3-carboxamide
2-[(2-anilino-2-oxoethyl)sulfanyl]-N-butyl-4-(hydroxymethyl)-6-methylpyridine-3-carboxamide
Compound characteristics
| Compound ID: | 8017-8598 |
| Compound Name: | 2-[(2-anilino-2-oxoethyl)sulfanyl]-N-butyl-4-(hydroxymethyl)-6-methylpyridine-3-carboxamide |
| Molecular Weight: | 387.5 |
| Molecular Formula: | C20 H25 N3 O3 S |
| Smiles: | CCCCNC(c1c(CO)cc(C)nc1SCC(Nc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5733 |
| logD: | 2.5733 |
| logSw: | -2.9202 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 73.311 |
| InChI Key: | ZMLVGWMKUQUCOT-UHFFFAOYSA-N |