2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl 3-(4-nitrophenyl)prop-2-enoate
Chemical Structure Depiction of
2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl 3-(4-nitrophenyl)prop-2-enoate
2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl 3-(4-nitrophenyl)prop-2-enoate
Compound characteristics
Compound ID: | 8009-4923 |
Compound Name: | 2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl 3-(4-nitrophenyl)prop-2-enoate |
Molecular Weight: | 413.41 |
Molecular Formula: | C19 H15 N3 O6 S |
Smiles: | COc1ccc2c(c1)sc(NC(COC(/C=C/c1ccc(cc1)[N+]([O-])=O)=O)=O)n2 |
Stereo: | ACHIRAL |
logP: | 4.5156 |
logD: | 4.5155 |
logSw: | -4.4898 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 94.337 |
InChI Key: | YUKBJLDBEOXWEE-UHFFFAOYSA-N |