2,2-bis(4-chlorophenoxy)-N-[(Z)-(1,3-diphenylpyrazol-4-yl)methylideneamino]acetamide

Formula:C30H22N4O3Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:high 2,2-bis(4-chlorophenoxy)-N-[(Z)-(1,3-diphenylpyrazol-4-yl)methylideneamino]acetamide is not a drug-like molecule.

MolName	2,2-bis(4-chlorophenoxy)-N-[(Z)-(1,3-diphenylpyrazol-4-yl)methylideneamino]acetamide
MolecularFormula	C30H22N4O3Cl2
Smiles	O=C(C(Oc(cc1)ccc1Cl)Oc(cc1)ccc1Cl)N/N=C\c1cn(-c2ccccc2)nc1-c1ccccc1
InChI	InChI=1S/C30H22Cl2N4O3/c31-23-11-15-26(16-12-23)38-30(39-27-17-13-24(32)14-18-27)29(37)34-33-19-22-20-36(25-9-5-2-6-10-25)35-28(22)21-7-3-1-4-8-21/h1-20,30H,(H,34,37)
InChIK	YZOQNWXONFHMSF-UHFFFAOYSA-N
TotalMolweight	557.436
Molweight	557.436
MonoisotopicMass	556.106895
CLogP	6.1452
CLogS	-7.757
H Acceptors	7
H Donors	1
TotalSurfaceArea	417.57
Relative PSA	0.17686
PolarSurfaceArea	77.74
Druglikeness	6.0288
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.46154
Fragments	1
Non HAtoms	39
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	9
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	29
Sp3Atoms	3
Symmetricatoms	14
Aromatic Nitrogens	2
StereoCon

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