N-[(Z)-(3-hydroxyphenyl)methylideneamino]-2-[[5-(3-nitrophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide

Formula:C23H18N6O4S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(3-hydroxyphenyl)methylideneamino]-2-[[5-(3-nitrophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide is a drug-like molecule.

MolName	N-[(Z)-(3-hydroxyphenyl)methylideneamino]-2-[[5-(3-nitrophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
MolecularFormula	C23H18N6O4S
Smiles	[O-][N+](c1cccc(-c(n2-c3ccccc3)nnc2SCC(N/N=C\c2cc(O)ccc2)=O)c1)=O
InChI	InChI=1S/C23H18N6O4S/c30-20-11-4-6-16(12-20)14-24-25-21(31)15-34-23-27-26-22(28(23)18-8-2-1-3-9-18)17-7-5-10-19(13-17)29(32)33/h1-14,30H,15H2,(H,25,31)
InChIK	KQZGYKIEIRZWIW-UHFFFAOYSA-N
TotalMolweight	474.5
Molweight	474.5
MonoisotopicMass	474.111024
CLogP	3.2645
CLogS	-8.58
H Acceptors	10
H Donors	2
TotalSurfaceArea	354.5
Relative PSA	0.35495
PolarSurfaceArea	163.52
Druglikeness	0.29732
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.52941
Fragments	1
Non HAtoms	34
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	4
Symmetricatoms	2
Aromatic Nitrogens	3
AcidicOxygens	1
StereoCon

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