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

Formula:C15H18N6O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 3-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]-N-[(Z)-3-phenylpropylideneamino]propanamide is a drug-like molecule.

MolName	3-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]-N-[(Z)-3-phenylpropylideneamino]propanamide
MolecularFormula	C15H18N6O3
Smiles	O=C(CCNC(C(N1)=O)=NNC1=O)N/N=C\CCc1ccccc1
InChI	InChI=1S/C15H18N6O3/c22-12(8-10-16-13-14(23)18-15(24)21-20-13)19-17-9-4-7-11-5-2-1-3-6-11/h1-3,5-6,9H,4,7-8,10H2,(H,16,20)(H,19,22)(H2,18,21,23,24)
InChIK	YXKNWXUZPRURGP-UHFFFAOYSA-N
TotalMolweight	330.347
Molweight	330.347
MonoisotopicMass	330.144039
CLogP	-0.0594
CLogS	-3.363
H Acceptors	9
H Donors	4
TotalSurfaceArea	261.62
Relative PSA	0.41274
PolarSurfaceArea	124.05
Druglikeness	5.8597
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.75
Fragments	1
Non HAtoms	24
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	4
Symmetricatoms	2
Amides	1
StereoCon

Click to Load Molecule:

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

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

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments