6-bromo-N-(8-butoxyquinolin-5-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
6-bromo-N-(8-butoxyquinolin-5-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
6-bromo-N-(8-butoxyquinolin-5-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D656-0128 |
| Compound Name: | 6-bromo-N-(8-butoxyquinolin-5-yl)-4-oxo-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 467.32 |
| Molecular Formula: | C23 H19 Br N2 O4 |
| Smiles: | [H]N(C(C1=CC(c2cc(ccc2O1)[Br])=O)=O)c1ccc(c2c1cccn2)OCCCC |
| Stereo: | ACHIRAL |
| logP: | 5.4311 |
| logD: | 5.428 |
| logSw: | -5.5918 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.488 |
| InChI Key: | QUUNZMFYABRJAD-UHFFFAOYSA-N |