N-[(Z)-3-(4-bromoanilino)-1-(1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide

Formula:C24H18N3O2Br Mutagenic:none Tumorigenic:high Reproductive Effective:none N-[(Z)-3-(4-bromoanilino)-1-(1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide is not a drug-like molecule.

MolName	N-[(Z)-3-(4-bromoanilino)-1-(1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C24H18N3O2Br
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C/c1c[nH]c2c1cccc2)Nc(cc1)ccc1Br
InChI	InChI=1S/C24H18BrN3O2/c25-18-10-12-19(13-11-18)27-24(30)22(28-23(29)16-6-2-1-3-7-16)14-17-15-26-21-9-5-4-8-20(17)21/h1-15,26H,(H,27,30)(H,28,29)
InChIK	ANFMYGZWESLOSE-UHFFFAOYSA-N
TotalMolweight	460.33
Molweight	460.33
MonoisotopicMass	459.058238
CLogP	5.1884
CLogS	-6.232
H Acceptors	5
H Donors	3
TotalSurfaceArea	318.71
Relative PSA	0.19764
PolarSurfaceArea	73.99
Druglikeness	1.3925
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.46667
Fragments	1
Non HAtoms	30
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Symmetricatoms	4
Amides	2
Aromatic Nitrogens	1
StereoCon

Click to Load Molecule:

1 - N-[(Z)-3-(4-bromoanilino)-1-(1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide | 2 - N-[(Z)-3-(4-bromoanilino)-1-(1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide

Request More Details | N-[(Z)-3-(4-bromoanilino)-1-(1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments