3-(5-bromothiophen-2-yl)-5-methyl-N-(3,4,5-trimethoxyphenyl)-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
3-(5-bromothiophen-2-yl)-5-methyl-N-(3,4,5-trimethoxyphenyl)-1,2-oxazole-4-carboxamide
3-(5-bromothiophen-2-yl)-5-methyl-N-(3,4,5-trimethoxyphenyl)-1,2-oxazole-4-carboxamide
Compound characteristics
Compound ID: | F082-0877 |
Compound Name: | 3-(5-bromothiophen-2-yl)-5-methyl-N-(3,4,5-trimethoxyphenyl)-1,2-oxazole-4-carboxamide |
Molecular Weight: | 453.31 |
Molecular Formula: | C18 H17 Br N2 O5 S |
Smiles: | Cc1c(C(Nc2cc(c(c(c2)OC)OC)OC)=O)c(c2ccc(s2)[Br])no1 |
Stereo: | ACHIRAL |
logP: | 3.6001 |
logD: | 3.5969 |
logSw: | -4.1282 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.286 |
InChI Key: | KHDQDWIHZFDHON-UHFFFAOYSA-N |