N-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-4-nitrobenzamide
Chemical Structure Depiction of
N-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-4-nitrobenzamide
N-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-4-nitrobenzamide
Compound characteristics
Compound ID: | 0800-0312 |
Compound Name: | N-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-4-nitrobenzamide |
Molecular Weight: | 361.32 |
Molecular Formula: | C16 H9 F2 N3 O3 S |
Smiles: | c1cc(ccc1C(Nc1nc(cs1)c1ccc(c(c1)F)F)=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 4.8167 |
logD: | 4.8158 |
logSw: | -5.0264 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.486 |
InChI Key: | XHBJILCIRGVBEO-UHFFFAOYSA-N |