N-[(5-bromopyridin-2-yl)carbamothioyl]-2-phenylquinoline-4-carboxamide
Chemical Structure Depiction of
N-[(5-bromopyridin-2-yl)carbamothioyl]-2-phenylquinoline-4-carboxamide
N-[(5-bromopyridin-2-yl)carbamothioyl]-2-phenylquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y501-1475 |
| Compound Name: | N-[(5-bromopyridin-2-yl)carbamothioyl]-2-phenylquinoline-4-carboxamide |
| Molecular Weight: | 463.35 |
| Molecular Formula: | C22 H15 Br N4 O S |
| Smiles: | c1ccc(cc1)c1cc(C(NC(Nc2ccc(cn2)[Br])=S)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 6.3175 |
| logD: | 6.3047 |
| logSw: | -6.1491 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.004 |
| InChI Key: | DFSGYEZFTYQZRR-UHFFFAOYSA-N |