N~1~,N~3~-bis(1,1-dioxo-2,3-dihydro-1H-1lambda~6~-thiophen-3-yl)-5-nitrobenzene-1,3-dicarboxamide
Chemical Structure Depiction of
N~1~,N~3~-bis(1,1-dioxo-2,3-dihydro-1H-1lambda~6~-thiophen-3-yl)-5-nitrobenzene-1,3-dicarboxamide
N~1~,N~3~-bis(1,1-dioxo-2,3-dihydro-1H-1lambda~6~-thiophen-3-yl)-5-nitrobenzene-1,3-dicarboxamide
Compound characteristics
Compound ID: | 8018-3694 |
Compound Name: | N~1~,N~3~-bis(1,1-dioxo-2,3-dihydro-1H-1lambda~6~-thiophen-3-yl)-5-nitrobenzene-1,3-dicarboxamide |
Molecular Weight: | 441.44 |
Molecular Formula: | C16 H15 N3 O8 S2 |
Smiles: | C1C(C=CS1(=O)=O)NC(c1cc(cc(c1)[N+]([O-])=O)C(NC1CS(C=C1)(=O)=O)=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | -0.6454 |
logD: | -0.646 |
logSw: | -2.0483 |
Hydrogen bond acceptors count: | 16 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 138.771 |
InChI Key: | FAPQBDTZVKXGLK-UHFFFAOYSA-N |