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MolName : [3-(4-chlorobenzoyl)oxy-4-[(Z)-(pyrazine-2-carbonylhydrazinylidene)methyl]phenyl] 4-chlorobenzoate

MolecularFormula : C26H16N4O5Cl2

Smiles : O=C(c1nccnc1)N/N=C\c(ccc(OC(c(cc1)ccc1Cl)=O)c1)c1OC(c(cc1)ccc1Cl)=O

InChI : InChI=1S/C26H16Cl2N4O5/c27-19-6-1-16(2-7-19)25(34)36-21-10-5-18(14-31-32-24(33)22-15-29-11-12-30-22)23(13-21)37-26(35)17-3-8-20(28)9-4-17/h1-15H,(H,32,33)

InChIK : ISCQQFKXOHAEKS-UHFFFAOYSA-N

TotalMolweight : 535.342

Molweight : 535.342

MonoisotopicMass : 534.049775

CLogP : 5.3268

CLogS : -6.567

H Acceptors : 9

H Donors : 1

TotalSurfaceArea : 390.37

Relative PSA : 0.26649

PolarSurfaceArea : 119.84

Druglikeness : 4.0416

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions : acyl-hydrazone; imine/hydrazone of aldehyde

Shape Index : 0.51351

Fragments : 1

Non HAtoms : 37

NonCHAtoms : 11

Electronegative Atoms : 11

Rotatable Bond : 9

Rings Closures : 4

Small Rings : 4

Aromatic Rings : 4

Aromatic Atoms : 24

Sp3Atoms : 2

Symmetricatoms : 4

Aromatic Nitrogens : 2

StereoCon :