3-chloro-N-{3-nitro-5-[(pyridin-3-yl)oxy]phenyl}-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-{3-nitro-5-[(pyridin-3-yl)oxy]phenyl}-1-benzothiophene-2-carboxamide
3-chloro-N-{3-nitro-5-[(pyridin-3-yl)oxy]phenyl}-1-benzothiophene-2-carboxamide
Compound characteristics
Compound ID: | 8002-7400 |
Compound Name: | 3-chloro-N-{3-nitro-5-[(pyridin-3-yl)oxy]phenyl}-1-benzothiophene-2-carboxamide |
Molecular Weight: | 425.85 |
Molecular Formula: | C20 H12 Cl N3 O4 S |
Smiles: | c1ccc2c(c1)c(c(C(Nc1cc(cc(c1)Oc1cccnc1)[N+]([O-])=O)=O)s2)[Cl] |
Stereo: | ACHIRAL |
logP: | 5.2752 |
logD: | 5.2343 |
logSw: | -5.9272 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 73.724 |
InChI Key: | KCFXYDAPFNMZFU-UHFFFAOYSA-N |