4-(4-chlorophenyl)-N-[(E)-(3-phenylmethoxyphenyl)methylideneamino]-1,3-thiazol-2-amine

Formula:C23H18N3OClS Mutagenic:none Tumorigenic:high Reproductive Effective:none 4-(4-chlorophenyl)-N-[(E)-(3-phenylmethoxyphenyl)methylideneamino]-1,3-thiazol-2-amine is not a drug-like molecule.

MolName4-(4-chlorophenyl)-N-[(E)-(3-phenylmethoxyphenyl)methylideneamino]-1,3-thiazol-2-amine
MolecularFormulaC23H18N3OClS
SmilesClc(cc1)ccc1-c1csc(N/N=C/c2cc(OCc3ccccc3)ccc2)n1
InChIInChI=1S/C23H18ClN3OS/c24-20-11-9-19(10-12-20)22-16-29-23(26-22)27-25-14-18-7-4-8-21(13-18)28-15-17-5-2-1-3-6-17/h1-14,16H,15H2,(H,26,27)
InChIKOWOTUHUHHJSIFN-UHFFFAOYSA-N
TotalMolweight419.935
Molweight419.935
MonoisotopicMass419.085909
CLogP8.1705
CLogS-6.737
H Acceptors4
H Donors1
TotalSurfaceArea322.64
Relative PSA0.19929
PolarSurfaceArea74.75
Druglikeness3.5513
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.68966
Fragments1
Non HAtoms29
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond7
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms23
Sp3Atoms2
Symmetricatoms4
Aromatic Nitrogens1
BasicNitrogens1
StereoCon

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