5-bromo-N-[(2,4-dimethoxyphenyl)carbamothioyl]pyridine-3-carboxamide
Chemical Structure Depiction of
5-bromo-N-[(2,4-dimethoxyphenyl)carbamothioyl]pyridine-3-carboxamide
5-bromo-N-[(2,4-dimethoxyphenyl)carbamothioyl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | 4194-0088 |
| Compound Name: | 5-bromo-N-[(2,4-dimethoxyphenyl)carbamothioyl]pyridine-3-carboxamide |
| Molecular Weight: | 396.26 |
| Molecular Formula: | C15 H14 Br N3 O3 S |
| Smiles: | COc1ccc(c(c1)OC)NC(NC(c1cc(cnc1)[Br])=O)=S |
| Stereo: | ACHIRAL |
| logP: | 3.3049 |
| logD: | 3.3023 |
| logSw: | -3.5273 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.324 |
| InChI Key: | LJVVPSDJQQKVBU-UHFFFAOYSA-N |