(E)-1-(1-benzofuran-2-yl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-en-1-one

Formula:C26H18N2O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-1-(1-benzofuran-2-yl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-1-(1-benzofuran-2-yl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-en-1-one
MolecularFormula	C26H18N2O2
Smiles	O=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1cc(cccc2)c2o1
InChI	InChI=1S/C26H18N2O2/c29-23(25-17-20-11-7-8-14-24(20)30-25)16-15-21-18-28(22-12-5-2-6-13-22)27-26(21)19-9-3-1-4-10-19/h1-18H
InChIK	KRKYDNCOJCKKRA-UHFFFAOYSA-N
TotalMolweight	390.441
Molweight	390.441
MonoisotopicMass	390.136828
CLogP	4.7284
CLogS	-6.536
H Acceptors	4
TotalSurfaceArea	309.04
Relative PSA	0.14558
PolarSurfaceArea	48.03
Druglikeness	3.6737
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	30
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	26
Symmetricatoms	4
Aromatic Nitrogens	2
StereoCon

Click to Load Molecule:

1 - (E)-1-(1-benzofuran-2-yl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-en-1-one | 2 - (E)-1-(1-benzofuran-2-yl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-en-1-one

Request More Details | (E)-1-(1-benzofuran-2-yl)-3-(1,3-diphenylpyrazol-4-yl)prop-2-en-1-one

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments