N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-2-(morpholin-4-yl)-5-nitrobenzamide
Chemical Structure Depiction of
N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-2-(morpholin-4-yl)-5-nitrobenzamide
N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-2-(morpholin-4-yl)-5-nitrobenzamide
Compound characteristics
Compound ID: | 7770-3940 |
Compound Name: | N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-2-(morpholin-4-yl)-5-nitrobenzamide |
Molecular Weight: | 490.54 |
Molecular Formula: | C25 H22 N4 O5 S |
Smiles: | COc1ccc(cc1NC(c1cc(ccc1N1CCOCC1)[N+]([O-])=O)=O)c1nc2ccccc2s1 |
Stereo: | ACHIRAL |
logP: | 4.8527 |
logD: | 4.8372 |
logSw: | -4.5918 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 84.153 |
InChI Key: | WOIIJLJYSBGKRV-UHFFFAOYSA-N |