(2E)-2-[(1,3-diphenylpyrazol-4-yl)methylidene]-3,4-dihydronaphthalen-1-one

Formula:C26H20N2O Mutagenic:none Tumorigenic:none Reproductive Effective:high (2E)-2-[(1,3-diphenylpyrazol-4-yl)methylidene]-3,4-dihydronaphthalen-1-one is a drug-like molecule.

MolName	(2E)-2-[(1,3-diphenylpyrazol-4-yl)methylidene]-3,4-dihydronaphthalen-1-one
MolecularFormula	C26H20N2O
Smiles	O=C(/C(/CC1)=C/c2cn(-c3ccccc3)nc2-c2ccccc2)c2c1cccc2
InChI	InChI=1S/C26H20N2O/c29-26-21(16-15-19-9-7-8-14-24(19)26)17-22-18-28(23-12-5-2-6-13-23)27-25(22)20-10-3-1-4-11-20/h1-14,17-18H,15-16H2
InChIK	IJUMEFAUBPDBRF-UHFFFAOYSA-N
TotalMolweight	376.458
Molweight	376.458
MonoisotopicMass	376.157563
CLogP	4.9318
CLogS	-5.796
H Acceptors	3
TotalSurfaceArea	296.98
Relative PSA	0.10398
PolarSurfaceArea	34.89
Druglikeness	2.4249
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.48276
Fragments	1
Non HAtoms	29
NonCHAtoms	3
Electronegative Atoms	3
Rotatable Bond	3
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	2
Symmetricatoms	4
Aromatic Nitrogens	2
StereoCon

Click to Load Molecule:

1 - (2E)-2-[(1,3-diphenylpyrazol-4-yl)methylidene]-3,4-dihydronaphthalen-1-one | 2 - (2E)-2-[(1,3-diphenylpyrazol-4-yl)methylidene]-3,4-dihydronaphthalen-1-one

Request More Details | (2E)-2-[(1,3-diphenylpyrazol-4-yl)methylidene]-3,4-dihydronaphthalen-1-one

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments