N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazole-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazole-4-carboxamide
Compound characteristics
Compound ID: | V016-1706 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazole-4-carboxamide |
Molecular Weight: | 412.46 |
Molecular Formula: | C21 H20 N2 O5 S |
Salt: | not_available |
Smiles: | CCOc1ccc(cc1OC)c1nc(cs1)C(NCc1ccc2c(c1)OCO2)=O |
Stereo: | ACHIRAL |
logP: | 3.9144 |
logD: | 3.9144 |
logSw: | -4.0872 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.342 |
InChI Key: | LNVJCSCQZAWRDZ-UHFFFAOYSA-N |