4-(2,4-dichlorophenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine

Formula:C15H10N4Cl2S Mutagenic:none Tumorigenic:high Reproductive Effective:none 4-(2,4-dichlorophenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine is not a drug-like molecule.

MolName4-(2,4-dichlorophenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine
MolecularFormulaC15H10N4Cl2S
SmilesClc(cc1)cc(Cl)c1-c1csc(N/N=C\c2cnccc2)n1
InChIInChI=1S/C15H10Cl2N4S/c16-11-3-4-12(13(17)6-11)14-9-22-15(20-14)21-19-8-10-2-1-5-18-7-10/h1-9H,(H,20,21)
InChIKSTHOOYABVADJOH-UHFFFAOYSA-N
TotalMolweight349.244
Molweight349.244
MonoisotopicMass348.00032
CLogP6.4275
CLogS-5.337
H Acceptors4
H Donors1
TotalSurfaceArea253.3
Relative PSA0.25768
PolarSurfaceArea78.41
Druglikeness4.0061
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.68182
Fragments1
Non HAtoms22
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond4
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms17
Aromatic Nitrogens2
BasicNitrogens1
StereoCon

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