N-[(Z)-(1-benzylindol-3-yl)methylideneamino]-5-(4-nitrophenyl)furan-2-carboxamide

Formula:C27H20N4O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(1-benzylindol-3-yl)methylideneamino]-5-(4-nitrophenyl)furan-2-carboxamide is a drug-like molecule.

MolName	N-[(Z)-(1-benzylindol-3-yl)methylideneamino]-5-(4-nitrophenyl)furan-2-carboxamide
MolecularFormula	C27H20N4O4
Smiles	[O-][N+](c(cc1)ccc1-c1ccc(C(N/N=C\c2cn(Cc3ccccc3)c3c2cccc3)=O)o1)=O
InChI	InChI=1S/C27H20N4O4/c32-27(26-15-14-25(35-26)20-10-12-22(13-11-20)31(33)34)29-28-16-21-18-30(17-19-6-2-1-3-7-19)24-9-5-4-8-23(21)24/h1-16,18H,17H2,(H,29,32)
InChIK	UCNNZUKQUPXNHL-UHFFFAOYSA-N
TotalMolweight	464.48
Molweight	464.48
MonoisotopicMass	464.148456
CLogP	4.7486
CLogS	-6.619
H Acceptors	8
H Donors	1
TotalSurfaceArea	357.43
Relative PSA	0.24455
PolarSurfaceArea	105.35
Druglikeness	2.0119
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.6
Fragments	1
Non HAtoms	35
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	26
Sp3Atoms	2
Symmetricatoms	4
Aromatic Nitrogens	1
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - N-[(Z)-(1-benzylindol-3-yl)methylideneamino]-5-(4-nitrophenyl)furan-2-carboxamide | 2 - N-[(Z)-(1-benzylindol-3-yl)methylideneamino]-5-(4-nitrophenyl)furan-2-carboxamide

Request More Details | N-[(Z)-(1-benzylindol-3-yl)methylideneamino]-5-(4-nitrophenyl)furan-2-carboxamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments