2-[(4-bromophenyl)sulfanyl]quinoline-4-carboxylic acid
Chemical Structure Depiction of
2-[(4-bromophenyl)sulfanyl]quinoline-4-carboxylic acid
2-[(4-bromophenyl)sulfanyl]quinoline-4-carboxylic acid
Compound characteristics
| Compound ID: | K784-2858 |
| Compound Name: | 2-[(4-bromophenyl)sulfanyl]quinoline-4-carboxylic acid |
| Molecular Weight: | 360.23 |
| Molecular Formula: | C16 H10 Br N O2 S |
| Smiles: | c1ccc2c(c1)c(cc(n2)Sc1ccc(cc1)[Br])C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5214 |
| logD: | 1.1513 |
| logSw: | -5.8029 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.067 |
| InChI Key: | SSDNXYTZMCTNAY-UHFFFAOYSA-N |