2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)sulfanyl]-N-[(Z)-(2-phenylmethoxyphenyl)methylideneamino]acetamide

Formula:C19H17N5O4S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)sulfanyl]-N-[(Z)-(2-phenylmethoxyphenyl)methylideneamino]acetamide is a drug-like molecule.

MolName	2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)sulfanyl]-N-[(Z)-(2-phenylmethoxyphenyl)methylideneamino]acetamide
MolecularFormula	C19H17N5O4S
Smiles	O=C(CSC(C(N1)=O)=NNC1=O)N/N=C\c(cccc1)c1OCc1ccccc1
InChI	InChI=1S/C19H17N5O4S/c25-16(12-29-18-17(26)21-19(27)24-23-18)22-20-10-14-8-4-5-9-15(14)28-11-13-6-2-1-3-7-13/h1-10H,11-12H2,(H,22,25)(H2,21,24,26,27)
InChIK	OQIXROXILWARSA-UHFFFAOYSA-N
TotalMolweight	411.441
Molweight	411.441
MonoisotopicMass	411.100125
CLogP	1.4466
CLogS	-4.267
H Acceptors	9
H Donors	3
TotalSurfaceArea	309.89
Relative PSA	0.40017
PolarSurfaceArea	146.55
Druglikeness	6.6808
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.65517
Fragments	1
Non HAtoms	29
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	2
Amides	1
StereoCon

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1 - 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)sulfanyl]-N-[(Z)-(2-phenylmethoxyphenyl)methylideneamino]acetamide | 2 - 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)sulfanyl]-N-[(Z)-(2-phenylmethoxyphenyl)methylideneamino]acetamide

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