2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-N-octylpyridine-3-carboxamide
Chemical Structure Depiction of
2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-N-octylpyridine-3-carboxamide
2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-N-octylpyridine-3-carboxamide
Compound characteristics
| Compound ID: | K781-3346 |
| Compound Name: | 2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-N-octylpyridine-3-carboxamide |
| Molecular Weight: | 379.56 |
| Molecular Formula: | C20 H33 N3 O2 S |
| Smiles: | CCCCCCCCNC(c1cccnc1SCC(NCCCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5289 |
| logD: | 4.5289 |
| logSw: | -4.3949 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.257 |
| InChI Key: | JOWUVBQOUGWTHJ-UHFFFAOYSA-N |