N-[(Z)-[2-[(3-bromophenyl)methoxy]phenyl]methylideneamino]-2-hydroxybenzamide

Formula:C21H17N2O3Br Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-[2-[(3-bromophenyl)methoxy]phenyl]methylideneamino]-2-hydroxybenzamide is a drug-like molecule.

MolNameN-[(Z)-[2-[(3-bromophenyl)methoxy]phenyl]methylideneamino]-2-hydroxybenzamide
MolecularFormulaC21H17N2O3Br
SmilesOc(cccc1)c1C(N/N=C\c(cccc1)c1OCc1cccc(Br)c1)=O
InChIInChI=1S/C21H17BrN2O3/c22-17-8-5-6-15(12-17)14-27-20-11-4-1-7-16(20)13-23-24-21(26)18-9-2-3-10-19(18)25/h1-13,25H,14H2,(H,24,26)
InChIKIZQUEONPNQCXOA-UHFFFAOYSA-N
TotalMolweight425.281
Molweight425.281
MonoisotopicMass424.042254
CLogP4.9292
CLogS-5.6
H Acceptors5
H Donors2
TotalSurfaceArea295.49
Relative PSA0.20004
PolarSurfaceArea70.92
Druglikeness2.2144
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.59259
Fragments1
Non HAtoms27
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond6
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms3
StereoCon

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