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

Formula:C23H17N3OCl2S Mutagenic:none Tumorigenic:high Reproductive Effective:none 4-(2,4-dichlorophenyl)-N-[(E)-(4-phenylmethoxyphenyl)methylideneamino]-1,3-thiazol-2-amine is not a drug-like molecule.

MolName4-(2,4-dichlorophenyl)-N-[(E)-(4-phenylmethoxyphenyl)methylideneamino]-1,3-thiazol-2-amine
MolecularFormulaC23H17N3OCl2S
SmilesClc(cc1)cc(Cl)c1-c1csc(N/N=C/c(cc2)ccc2OCc2ccccc2)n1
InChIInChI=1S/C23H17Cl2N3OS/c24-18-8-11-20(21(25)12-18)22-15-30-23(27-22)28-26-13-16-6-9-19(10-7-16)29-14-17-4-2-1-3-5-17/h1-13,15H,14H2,(H,27,28)
InChIKIWWCVOYYUKANRZ-UHFFFAOYSA-N
TotalMolweight454.38
Molweight454.38
MonoisotopicMass453.046936
CLogP8.7765
CLogS-7.473
H Acceptors4
H Donors1
TotalSurfaceArea338.06
Relative PSA0.1902
PolarSurfaceArea74.75
Druglikeness3.5513
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.7
Fragments1
Non HAtoms30
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond7
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms23
Sp3Atoms2
Symmetricatoms4
Aromatic Nitrogens1
BasicNitrogens1
StereoCon

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