N-{2-[2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]ethyl}-3-nitrobenzamide
Chemical Structure Depiction of
N-{2-[2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]ethyl}-3-nitrobenzamide
N-{2-[2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]ethyl}-3-nitrobenzamide
Compound characteristics
Compound ID: | G856-2870 |
Compound Name: | N-{2-[2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]ethyl}-3-nitrobenzamide |
Molecular Weight: | 397.45 |
Molecular Formula: | C20 H19 N3 O4 S |
Smiles: | Cc1c(CCNC(c2cccc(c2)[N+]([O-])=O)=O)sc(c2ccc(cc2)OC)n1 |
Stereo: | ACHIRAL |
logP: | 4.1305 |
logD: | 4.1305 |
logSw: | -4.3561 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 75.729 |
InChI Key: | MNOUUDNNLQWVKK-UHFFFAOYSA-N |