2-[4-(6-bromo-2-oxo-2H-1-benzopyran-3-yl)phenoxy]-N-[(2S)-1-hydroxypropan-2-yl]acetamide
Chemical Structure Depiction of
2-[4-(6-bromo-2-oxo-2H-1-benzopyran-3-yl)phenoxy]-N-[(2S)-1-hydroxypropan-2-yl]acetamide
2-[4-(6-bromo-2-oxo-2H-1-benzopyran-3-yl)phenoxy]-N-[(2S)-1-hydroxypropan-2-yl]acetamide
Compound characteristics
| Compound ID: | D715-1478 |
| Compound Name: | 2-[4-(6-bromo-2-oxo-2H-1-benzopyran-3-yl)phenoxy]-N-[(2S)-1-hydroxypropan-2-yl]acetamide |
| Molecular Weight: | 432.27 |
| Molecular Formula: | C20 H18 Br N O5 |
| Smiles: | C[C@@H](CO)NC(COc1ccc(cc1)C1=Cc2cc(ccc2OC1=O)[Br])=O |
| Stereo: | ABSOLUTE |
| logP: | 2.8905 |
| logD: | 2.8905 |
| logSw: | -3.3571 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.416 |
| InChI Key: | LRBOBBCHGCTBNH-LBPRGKRZSA-N |