2-bromo-N-{2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}benzamide
Chemical Structure Depiction of
2-bromo-N-{2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}benzamide
2-bromo-N-{2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}benzamide
Compound characteristics
Compound ID: | P181-0530 |
Compound Name: | 2-bromo-N-{2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}benzamide |
Molecular Weight: | 440.32 |
Molecular Formula: | C20 H14 Br N3 O2 S |
Smiles: | Cc1ccc(cc1)c1nc(c2c(ccs2)NC(c2ccccc2[Br])=O)on1 |
Stereo: | ACHIRAL |
logP: | 5.5514 |
logD: | 5.5512 |
logSw: | -5.4403 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.056 |
InChI Key: | KJTCBMJAHFXCRX-UHFFFAOYSA-N |