[(E)-[1-amino-2-(4-nitrophenoxy)ethylidene]amino] 2,5-dichloropyridine-3-carboxylate

Formula:C14H10N4O5Cl2 Mutagenic:high Tumorigenic:none Reproductive Effective:low [(E)-[1-amino-2-(4-nitrophenoxy)ethylidene]amino] 2,5-dichloropyridine-3-carboxylate is a drug-like molecule.

MolName	[(E)-[1-amino-2-(4-nitrophenoxy)ethylidene]amino] 2,5-dichloropyridine-3-carboxylate
MolecularFormula	C14H10N4O5Cl2
Smiles	N/C(/COc(cc1)ccc1[N+]([O-])=O)=N/OC(c1cc(Cl)cnc1Cl)=O
InChI	InChI=1S/C14H10Cl2N4O5/c15-8-5-11(13(16)18-6-8)14(21)25-19-12(17)7-24-10-3-1-9(2-4-10)20(22)23/h1-6H,7H2,(H2,17,19)
InChIK	REFJIAZCDAFMBR-UHFFFAOYSA-N
TotalMolweight	385.162
Molweight	385.162
MonoisotopicMass	384.002825
CLogP	2.0339
CLogS	-4.216
H Acceptors	9
H Donors	1
TotalSurfaceArea	269.29
Relative PSA	0.37584
PolarSurfaceArea	132.62
Druglikeness	-7.8044
Mutagenic	high
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.64
Fragments	1
Non HAtoms	25
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	2
Aromatic Nitrogens	1
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - [(E)-[1-amino-2-(4-nitrophenoxy)ethylidene]amino] 2,5-dichloropyridine-3-carboxylate | 2 - [(E)-[1-amino-2-(4-nitrophenoxy)ethylidene]amino] 2,5-dichloropyridine-3-carboxylate

Request More Details | [(E)-[1-amino-2-(4-nitrophenoxy)ethylidene]amino] 2,5-dichloropyridine-3-carboxylate

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments