2-(4-nitrophenyl)-1,3-benzothiazole
Chemical Structure Depiction of
2-(4-nitrophenyl)-1,3-benzothiazole
2-(4-nitrophenyl)-1,3-benzothiazole
Compound characteristics
Compound ID: | Y020-5268 |
Compound Name: | 2-(4-nitrophenyl)-1,3-benzothiazole |
Molecular Weight: | 256.28 |
Molecular Formula: | C13 H8 N2 O2 S |
Smiles: | c1ccc2c(c1)nc(c1ccc(cc1)[N+]([O-])=O)s2 |
Stereo: | ACHIRAL |
logP: | 4.1397 |
logD: | 4.1397 |
logSw: | -4.5845 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 43.069 |
InChI Key: | KEJBDGQLLLLBGE-UHFFFAOYSA-N |