2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[1-(4-hydroxy-3-methoxyphenyl)ethylideneamino]acetamide

Formula:C24H21N6O3ClS Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[1-(4-hydroxy-3-methoxyphenyl)ethylideneamino]acetamide is not a drug-like molecule.

MolName	2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[1-(4-hydroxy-3-methoxyphenyl)ethylideneamino]acetamide
MolecularFormula	C24H21N6O3ClS
Smiles	CC(c(cc1)cc(OC)c1O)=NNC(CSc1nnc(-c2ccncc2)n1-c(cc1)ccc1Cl)=O
InChI	InChI=1S/C24H21ClN6O3S/c1-15(17-3-8-20(32)21(13-17)34-2)27-28-22(33)14-35-24-30-29-23(16-9-11-26-12-10-16)31(24)19-6-4-18(25)5-7-19/h3-13,32H,14H2,1-2H3,(H,28,33)
InChIK	NMIUVMHJZFVZJS-UHFFFAOYSA-N
TotalMolweight	508.989
Molweight	508.989
MonoisotopicMass	508.108436
CLogP	3.6591
CLogS	-8.439
H Acceptors	9
H Donors	2
TotalSurfaceArea	377.74
Relative PSA	0.3081
PolarSurfaceArea	139.82
Druglikeness	4.4491
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone
Shape Index	0.51429
Fragments	1
Non HAtoms	35
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	6
Symmetricatoms	4
Aromatic Nitrogens	4
StereoCon

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1 - 2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[1-(4-hydroxy-3-methoxyphenyl)ethylideneamino]acetamide | 2 - 2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-N-[1-(4-hydroxy-3-methoxyphenyl)ethylideneamino]acetamide

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