2-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}-N-(4-ethylphenyl)-4,6-dimethylpyridine-3-carboxamide
Chemical Structure Depiction of
2-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}-N-(4-ethylphenyl)-4,6-dimethylpyridine-3-carboxamide
2-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}-N-(4-ethylphenyl)-4,6-dimethylpyridine-3-carboxamide
Compound characteristics
| Compound ID: | D276-0808 |
| Compound Name: | 2-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}-N-(4-ethylphenyl)-4,6-dimethylpyridine-3-carboxamide |
| Molecular Weight: | 399.55 |
| Molecular Formula: | C22 H29 N3 O2 S |
| Smiles: | CCc1ccc(cc1)NC(c1c(C)cc(C)nc1SCC(NC(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.886 |
| logD: | 4.8851 |
| logSw: | -4.7475 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.179 |
| InChI Key: | JOHLIYHJDXKLKG-UHFFFAOYSA-N |