pentyl (5-bromo-7-methyl-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)acetate
Chemical Structure Depiction of
pentyl (5-bromo-7-methyl-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)acetate
pentyl (5-bromo-7-methyl-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)acetate
Compound characteristics
| Compound ID: | D011-1085 |
| Compound Name: | pentyl (5-bromo-7-methyl-2,3-dioxo-2,3-dihydro-1H-indol-1-yl)acetate |
| Molecular Weight: | 368.23 |
| Molecular Formula: | C16 H18 Br N O4 |
| Smiles: | CCCCCOC(CN1C(C(c2cc(cc(C)c12)[Br])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3469 |
| logD: | 4.3469 |
| logSw: | -4.2576 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.735 |
| InChI Key: | XPECWKFTYNXYOA-UHFFFAOYSA-N |