N-[(Z)-[4-[(4-bromophenyl)methoxy]phenyl]methylideneamino]-4-(2,4-dichlorophenyl)-1,3-thiazol-2-amine

Formula:C23H16N3OBrCl2S Mutagenic:none Tumorigenic:high Reproductive Effective:none N-[(Z)-[4-[(4-bromophenyl)methoxy]phenyl]methylideneamino]-4-(2,4-dichlorophenyl)-1,3-thiazol-2-amine is not a drug-like molecule.

MolNameN-[(Z)-[4-[(4-bromophenyl)methoxy]phenyl]methylideneamino]-4-(2,4-dichlorophenyl)-1,3-thiazol-2-amine
MolecularFormulaC23H16N3OBrCl2S
SmilesClc(cc1)cc(Cl)c1-c1csc(N/N=C\c(cc2)ccc2OCc(cc2)ccc2Br)n1
InChIInChI=1S/C23H16BrCl2N3OS/c24-17-5-1-16(2-6-17)13-30-19-8-3-15(4-9-19)12-27-29-23-28-22(14-31-23)20-10-7-18(25)11-21(20)26/h1-12,14H,13H2,(H,28,29)
InChIKHGOLBYKMQWAVQC-UHFFFAOYSA-N
TotalMolweight533.276
Molweight533.276
MonoisotopicMass530.957447
CLogP9.5017
CLogS-8.307
H Acceptors4
H Donors1
TotalSurfaceArea356.69
Relative PSA0.18027
PolarSurfaceArea74.75
Druglikeness1.7613
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.70968
Fragments1
Non HAtoms31
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond7
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms23
Sp3Atoms2
Symmetricatoms4
Aromatic Nitrogens1
BasicNitrogens1
StereoCon

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