2-bromo-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzamide
Chemical Structure Depiction of
2-bromo-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzamide
2-bromo-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzamide
Compound characteristics
Compound ID: | D101-0178 |
Compound Name: | 2-bromo-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzamide |
Molecular Weight: | 388.22 |
Molecular Formula: | C17 H14 Br N3 O3 |
Smiles: | COc1ccc(cc1)c1nc(CNC(c2ccccc2[Br])=O)on1 |
Stereo: | ACHIRAL |
logP: | 3.9725 |
logD: | 3.9723 |
logSw: | -4.2528 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.539 |
InChI Key: | HQTHALPLHFTPSY-UHFFFAOYSA-N |