[3-(5-bromopyridin-3-yl)-1H-1,2,4-triazol-5-yl]acetic acid
Chemical Structure Depiction of
[3-(5-bromopyridin-3-yl)-1H-1,2,4-triazol-5-yl]acetic acid
[3-(5-bromopyridin-3-yl)-1H-1,2,4-triazol-5-yl]acetic acid
Compound characteristics
Compound ID: | 8020-5455 |
Compound Name: | [3-(5-bromopyridin-3-yl)-1H-1,2,4-triazol-5-yl]acetic acid |
Molecular Weight: | 283.08 |
Molecular Formula: | C9 H7 Br N4 O2 |
Smiles: | C(C(O)=O)c1nc(c2cc(cnc2)[Br])n[nH]1 |
Stereo: | ACHIRAL |
logP: | 1.2029 |
logD: | -2.0316 |
logSw: | -1.7882 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 73.005 |
InChI Key: | SGCHWNAETQCKII-UHFFFAOYSA-N |