N'-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-N-(2-phenylethyl)oxamide

Formula:C18H17N3O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none N'-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-N-(2-phenylethyl)oxamide is a drug-like molecule.

MolName	N'-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-N-(2-phenylethyl)oxamide
MolecularFormula	C18H17N3O4
Smiles	O=C(C(N/N=C\c(cc1)cc2c1OCO2)=O)NCCc1ccccc1
InChI	InChI=1S/C18H17N3O4/c22-17(19-9-8-13-4-2-1-3-5-13)18(23)21-20-11-14-6-7-15-16(10-14)25-12-24-15/h1-7,10-11H,8-9,12H2,(H,19,22)(H,21,23)
InChIK	BRFCREDCMTYIPP-UHFFFAOYSA-N
TotalMolweight	339.35
Molweight	339.35
MonoisotopicMass	339.121907
CLogP	2.3948
CLogS	-4.164
H Acceptors	7
H Donors	2
TotalSurfaceArea	263.98
Relative PSA	0.30499
PolarSurfaceArea	89.02
Druglikeness	3.9309
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide
Shape Index	0.68
Fragments	1
Non HAtoms	25
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	2
Amides	1
StereoCon

Click to Load Molecule:

1 - N'-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-N-(2-phenylethyl)oxamide | 2 - N'-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-N-(2-phenylethyl)oxamide

Request More Details | N'-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-N-(2-phenylethyl)oxamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments