[(6-bromo-2,1,3-benzoxadiazol-4-yl)sulfanyl]acetic acid
Chemical Structure Depiction of
[(6-bromo-2,1,3-benzoxadiazol-4-yl)sulfanyl]acetic acid
[(6-bromo-2,1,3-benzoxadiazol-4-yl)sulfanyl]acetic acid
Compound characteristics
| Compound ID: | 8020-8332 |
| Compound Name: | [(6-bromo-2,1,3-benzoxadiazol-4-yl)sulfanyl]acetic acid |
| Molecular Weight: | 289.1 |
| Molecular Formula: | C8 H5 Br N2 O3 S |
| Smiles: | C(C(O)=O)Sc1cc(cc2c1non2)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.3839 |
| logD: | -1.1024 |
| logSw: | -2.0684 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.712 |
| InChI Key: | NYYUFAHFOSCGLX-UHFFFAOYSA-N |