2-(4-butoxyphenyl)-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-(4-butoxyphenyl)-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]quinoline-4-carboxamide
2-(4-butoxyphenyl)-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y500-0352 |
| Compound Name: | 2-(4-butoxyphenyl)-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]quinoline-4-carboxamide |
| Molecular Weight: | 531.65 |
| Molecular Formula: | C28 H25 N3 O4 S2 |
| Smiles: | CCCCOc1ccc(cc1)c1cc(C(Nc2nc3ccc(cc3s2)S(C)(=O)=O)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 6.5425 |
| logD: | 6.5424 |
| logSw: | -5.806 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.317 |
| InChI Key: | CTVDNPNLNBSVBB-UHFFFAOYSA-N |