(5Z)-5-[[4-(3,5-diphenylpyrazol-1-yl)phenyl]methylidene]-2-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one

Formula:C32H21N5OS Mutagenic:high Tumorigenic:low Reproductive Effective:low (5Z)-5-[[4-(3,5-diphenylpyrazol-1-yl)phenyl]methylidene]-2-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one is not a drug-like molecule.

MolName	(5Z)-5-[[4-(3,5-diphenylpyrazol-1-yl)phenyl]methylidene]-2-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
MolecularFormula	C32H21N5OS
Smiles	O=C1n2nc(-c3ccccc3)nc2S/C1=C\c(cc1)ccc1-n(c(-c1ccccc1)c1)nc1-c1ccccc1
InChI	InChI=1S/C32H21N5OS/c38-31-29(39-32-33-30(35-37(31)32)25-14-8-3-9-15-25)20-22-16-18-26(19-17-22)36-28(24-12-6-2-7-13-24)21-27(34-36)23-10-4-1-5-11-23/h1-21H
InChIK	CUYFJRCDOMODSV-UHFFFAOYSA-N
TotalMolweight	523.619
Molweight	523.619
MonoisotopicMass	523.14668
CLogP	6.0246
CLogS	-8.841
H Acceptors	6
TotalSurfaceArea	393.19
Relative PSA	0.19629
PolarSurfaceArea	90.9
Druglikeness	4.7715
Mutagenic	high
Tumorigenic	low
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.53846
Fragments	1
Non HAtoms	39
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	7
Small Rings	7
Aromatic Rings	6
Aromatic Atoms	34
Sp3Atoms	1
Symmetricatoms	8
Aromatic Nitrogens	5
StereoCon

Click to Load Molecule:

1 - (5Z)-5-[[4-(3,5-diphenylpyrazol-1-yl)phenyl]methylidene]-2-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one | 2 - (5Z)-5-[[4-(3,5-diphenylpyrazol-1-yl)phenyl]methylidene]-2-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one

Request More Details | (5Z)-5-[[4-(3,5-diphenylpyrazol-1-yl)phenyl]methylidene]-2-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments