(4-nitrophenyl)methyl [(1,3-benzothiazol-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
(4-nitrophenyl)methyl [(1,3-benzothiazol-2-yl)sulfanyl]acetate
(4-nitrophenyl)methyl [(1,3-benzothiazol-2-yl)sulfanyl]acetate
Compound characteristics
Compound ID: | F235-0941 |
Compound Name: | (4-nitrophenyl)methyl [(1,3-benzothiazol-2-yl)sulfanyl]acetate |
Molecular Weight: | 360.41 |
Molecular Formula: | C16 H12 N2 O4 S2 |
Smiles: | C(c1ccc(cc1)[N+]([O-])=O)OC(CSc1nc2ccccc2s1)=O |
Stereo: | ACHIRAL |
logP: | 4.6055 |
logD: | 4.6055 |
logSw: | -4.7887 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 62.964 |
InChI Key: | PQBCAJSLFFQQPL-UHFFFAOYSA-N |