N-{2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]ethyl}-2-(4-nitrophenoxy)acetamide
Chemical Structure Depiction of
N-{2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]ethyl}-2-(4-nitrophenoxy)acetamide
N-{2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]ethyl}-2-(4-nitrophenoxy)acetamide
Compound characteristics
Compound ID: | D335-3092 |
Compound Name: | N-{2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]ethyl}-2-(4-nitrophenoxy)acetamide |
Molecular Weight: | 397.45 |
Molecular Formula: | C20 H19 N3 O4 S |
Smiles: | [H]N(CCc1csc(c2ccc(C)cc2)n1)C(COc1ccc(cc1)[N+]([O-])=O)=O |
Stereo: | ACHIRAL |
logP: | 4.0198 |
logD: | 4.0198 |
logSw: | -4.0616 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 75.39 |
InChI Key: | XTWDSUIABBWNNG-UHFFFAOYSA-N |