3-(3,5-dioxo-2H-1,2,4-triazin-6-yl)-N-[(Z)-3-phenylpropylideneamino]propanamide

Formula:C15H17N5O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 3-(3,5-dioxo-2H-1,2,4-triazin-6-yl)-N-[(Z)-3-phenylpropylideneamino]propanamide is a drug-like molecule.

MolName	3-(3,5-dioxo-2H-1,2,4-triazin-6-yl)-N-[(Z)-3-phenylpropylideneamino]propanamide
MolecularFormula	C15H17N5O3
Smiles	O=C(CCC(C(N1)=O)=NNC1=O)N/N=C\CCc1ccccc1
InChI	InChI=1S/C15H17N5O3/c21-13(9-8-12-14(22)17-15(23)20-18-12)19-16-10-4-7-11-5-2-1-3-6-11/h1-3,5-6,10H,4,7-9H2,(H,19,21)(H2,17,20,22,23)
InChIK	GDBRUERZKJYYBC-UHFFFAOYSA-N
TotalMolweight	315.332
Molweight	315.332
MonoisotopicMass	315.13314
CLogP	1.0696
CLogS	-3.788
H Acceptors	8
H Donors	3
TotalSurfaceArea	250.16
Relative PSA	0.38583
PolarSurfaceArea	112.02
Druglikeness	5.9054
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.73913
Fragments	1
Non HAtoms	23
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	4
Symmetricatoms	2
Amides	1
StereoCon

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