6-{2-[3-(4-bromophenyl)-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl]acetamido}hexanoic acid
Chemical Structure Depiction of
6-{2-[3-(4-bromophenyl)-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl]acetamido}hexanoic acid
6-{2-[3-(4-bromophenyl)-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl]acetamido}hexanoic acid
Compound characteristics
| Compound ID: | Y041-1857 |
| Compound Name: | 6-{2-[3-(4-bromophenyl)-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl]acetamido}hexanoic acid |
| Molecular Weight: | 526.38 |
| Molecular Formula: | C26 H24 Br N O6 |
| Smiles: | CC1=C(CC(NCCCCCC(O)=O)=O)C(=O)Oc2cc3c(cc12)c(co3)c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.3276 |
| logD: | 1.4995 |
| logSw: | -4.1495 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.145 |
| InChI Key: | XPALLFOGSSWDNK-UHFFFAOYSA-N |