2-chloro-N-(1-ethyl-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)-5-nitrobenzamide
Chemical Structure Depiction of
2-chloro-N-(1-ethyl-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)-5-nitrobenzamide
2-chloro-N-(1-ethyl-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)-5-nitrobenzamide
Compound characteristics
Compound ID: | 0573-2200 |
Compound Name: | 2-chloro-N-(1-ethyl-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)-5-nitrobenzamide |
Molecular Weight: | 395.8 |
Molecular Formula: | C20 H14 Cl N3 O4 |
Smiles: | CCN1C(c2cccc3c(ccc1c23)NC(c1cc(ccc1[Cl])[N+]([O-])=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.0276 |
logD: | 3.9731 |
logSw: | -4.4686 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.207 |
InChI Key: | QEQHXEMKAVWCHA-UHFFFAOYSA-N |