(Z)-2-cyano-3-(2,5-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)prop-2-enamide

Formula:C18H23N3O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-2-cyano-3-(2,5-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)prop-2-enamide is a drug-like molecule.

MolName	(Z)-2-cyano-3-(2,5-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)prop-2-enamide
MolecularFormula	C18H23N3O4
Smiles	COc(cc1)cc(/C=C(\C(NCCN2CCOCC2)=O)/C#N)c1OC
InChI	InChI=1S/C18H23N3O4/c1-23-16-3-4-17(24-2)14(12-16)11-15(13-19)18(22)20-5-6-21-7-9-25-10-8-21/h3-4,11-12H,5-10H2,1-2H3,(H,20,22)
InChIK	ZEEWKFBPPGJHFS-UHFFFAOYSA-N
TotalMolweight	345.398
Molweight	345.398
MonoisotopicMass	345.168857
CLogP	0.8084
CLogS	-1.789
H Acceptors	7
H Donors	1
TotalSurfaceArea	282.77
Relative PSA	0.25324
PolarSurfaceArea	83.82
Druglikeness	0.68404
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.6
Fragments	1
Non HAtoms	25
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	12
Symmetricatoms	2
Amides	1
Amines	1
AlkylAmines	1
BasicNitrogens	1
StereoCon

Click to Load Molecule:

1 - (Z)-2-cyano-3-(2,5-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)prop-2-enamide | 2 - (Z)-2-cyano-3-(2,5-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)prop-2-enamide

Request More Details | (Z)-2-cyano-3-(2,5-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)prop-2-enamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments