N-[3-(5-methylthiophen-2-yl)-1,2-oxazol-5-yl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[3-(5-methylthiophen-2-yl)-1,2-oxazol-5-yl]-2H-1,3-benzodioxole-5-carboxamide
N-[3-(5-methylthiophen-2-yl)-1,2-oxazol-5-yl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
Compound ID: | M466-1342 |
Compound Name: | N-[3-(5-methylthiophen-2-yl)-1,2-oxazol-5-yl]-2H-1,3-benzodioxole-5-carboxamide |
Molecular Weight: | 328.34 |
Molecular Formula: | C16 H12 N2 O4 S |
Smiles: | Cc1ccc(c2cc(NC(c3ccc4c(c3)OCO4)=O)on2)s1 |
Stereo: | ACHIRAL |
logP: | 3.9474 |
logD: | 3.9464 |
logSw: | -4.0775 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.744 |
InChI Key: | GGKMXNMKAQWZGI-UHFFFAOYSA-N |