2-[(4-fluorophenyl)sulfanyl]-4,6-dinitrobenzamide
Chemical Structure Depiction of
2-[(4-fluorophenyl)sulfanyl]-4,6-dinitrobenzamide
2-[(4-fluorophenyl)sulfanyl]-4,6-dinitrobenzamide
Compound characteristics
Compound ID: | 8009-7123 |
Compound Name: | 2-[(4-fluorophenyl)sulfanyl]-4,6-dinitrobenzamide |
Molecular Weight: | 337.28 |
Molecular Formula: | C13 H8 F N3 O5 S |
Smiles: | c1cc(ccc1F)Sc1cc(cc(c1C(N)=O)[N+]([O-])=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 2.0481 |
logD: | 2.0481 |
logSw: | -2.6634 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 100.488 |
InChI Key: | AVUBVMPXFUVMNT-UHFFFAOYSA-N |