2-{[2-(4-bromoanilino)-2-oxoethyl]sulfanyl}-N-propylpyridine-3-carboxamide
Chemical Structure Depiction of
2-{[2-(4-bromoanilino)-2-oxoethyl]sulfanyl}-N-propylpyridine-3-carboxamide
2-{[2-(4-bromoanilino)-2-oxoethyl]sulfanyl}-N-propylpyridine-3-carboxamide
Compound characteristics
| Compound ID: | K781-3273 |
| Compound Name: | 2-{[2-(4-bromoanilino)-2-oxoethyl]sulfanyl}-N-propylpyridine-3-carboxamide |
| Molecular Weight: | 408.31 |
| Molecular Formula: | C17 H18 Br N3 O2 S |
| Smiles: | CCCNC(c1cccnc1SCC(Nc1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5243 |
| logD: | 3.5242 |
| logSw: | -3.771 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.822 |
| InChI Key: | SYHDCADCTKPYPP-UHFFFAOYSA-N |