N-[(Z)-3-(4-bromoanilino)-3-oxo-1-phenylprop-1-en-2-yl]furan-2-carboxamide

Formula:C20H15N2O3Br Mutagenic:none Tumorigenic:high Reproductive Effective:none N-[(Z)-3-(4-bromoanilino)-3-oxo-1-phenylprop-1-en-2-yl]furan-2-carboxamide is a drug-like molecule.

MolName	N-[(Z)-3-(4-bromoanilino)-3-oxo-1-phenylprop-1-en-2-yl]furan-2-carboxamide
MolecularFormula	C20H15N2O3Br
Smiles	O=C(/C(/NC(c1ccco1)=O)=C/c1ccccc1)Nc(cc1)ccc1Br
InChI	InChI=1S/C20H15BrN2O3/c21-15-8-10-16(11-9-15)22-19(24)17(13-14-5-2-1-3-6-14)23-20(25)18-7-4-12-26-18/h1-13H,(H,22,24)(H,23,25)
InChIK	HNMFVSKWVSYDEU-UHFFFAOYSA-N
TotalMolweight	411.254
Molweight	411.254
MonoisotopicMass	410.026604
CLogP	4.3377
CLogS	-5.389
H Acceptors	5
H Donors	2
TotalSurfaceArea	284.23
Relative PSA	0.22204
PolarSurfaceArea	71.34
Druglikeness	1.0266
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	26
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Symmetricatoms	4
Amides	2
StereoCon

Click to Load Molecule:

1 - N-[(Z)-3-(4-bromoanilino)-3-oxo-1-phenylprop-1-en-2-yl]furan-2-carboxamide | 2 - N-[(Z)-3-(4-bromoanilino)-3-oxo-1-phenylprop-1-en-2-yl]furan-2-carboxamide

Request More Details | N-[(Z)-3-(4-bromoanilino)-3-oxo-1-phenylprop-1-en-2-yl]furan-2-carboxamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments