N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(5-bromothiophen-2-yl)-5-methyl-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(5-bromothiophen-2-yl)-5-methyl-1,2-oxazole-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(5-bromothiophen-2-yl)-5-methyl-1,2-oxazole-4-carboxamide
Compound characteristics
Compound ID: | F082-0868 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(5-bromothiophen-2-yl)-5-methyl-1,2-oxazole-4-carboxamide |
Molecular Weight: | 421.27 |
Molecular Formula: | C17 H13 Br N2 O4 S |
Smiles: | Cc1c(C(NCc2ccc3c(c2)OCO3)=O)c(c2ccc(s2)[Br])no1 |
Stereo: | ACHIRAL |
logP: | 3.6717 |
logD: | 3.6717 |
logSw: | -4.1567 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.746 |
InChI Key: | GJWLJWTXKWFUAP-UHFFFAOYSA-N |