(2Z)-6-benzyl-2-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

Formula:C23H14N4O5S Mutagenic:high Tumorigenic:high Reproductive Effective:none (2Z)-6-benzyl-2-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione is a drug-like molecule.

MolName	(2Z)-6-benzyl-2-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione
MolecularFormula	C23H14N4O5S
Smiles	[O-][N+](c(cc1)ccc1-c1ccc(/C=C(/C(N2N=C3Cc4ccccc4)=O)\SC2=NC3=O)o1)=O
InChI	InChI=1S/C23H14N4O5S/c28-21-18(12-14-4-2-1-3-5-14)25-26-22(29)20(33-23(26)24-21)13-17-10-11-19(32-17)15-6-8-16(9-7-15)27(30)31/h1-11,13H,12H2
InChIK	IAOPRMAZUZZXHM-UHFFFAOYSA-N
TotalMolweight	458.453
Molweight	458.453
MonoisotopicMass	458.068491
CLogP	2.7351
CLogS	-6.649
H Acceptors	9
TotalSurfaceArea	326.84
Relative PSA	0.35084
PolarSurfaceArea	146.36
Druglikeness	1.6325
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.60606
Fragments	1
Non HAtoms	33
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Symmetricatoms	4
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - (2Z)-6-benzyl-2-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione | 2 - (2Z)-6-benzyl-2-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

Request More Details | (2Z)-6-benzyl-2-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments