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MolName : 2-[benzyl(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)amino]-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]acetamide

MolecularFormula : C24H21N3O5Cl2S

Smiles : O=C(CN(Cc1ccccc1)S(c(cc1)cc2c1OCCO2)(=O)=O)N/N=C\c(ccc(Cl)c1)c1Cl

InChI : InChI=1S/C24H21Cl2N3O5S/c25-19-7-6-18(21(26)12-19)14-27-28-24(30)16-29(15-17-4-2-1-3-5-17)35(31,32)20-8-9-22-23(13-20)34-11-10-33-22/h1-9,12-14H,10-11,15-16H2,(H,28,30)

InChIK : SSTUCQJEDLQHEH-UHFFFAOYSA-N

TotalMolweight : 534.419

Molweight : 534.419

MonoisotopicMass : 533.057896

CLogP : 4.674

CLogS : -5.599

H Acceptors : 8

H Donors : 1

TotalSurfaceArea : 378.01

Relative PSA : 0.23317

PolarSurfaceArea : 105.68

Druglikeness : -0.3853

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

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

Shape Index : 0.51429

Fragments : 1

Non HAtoms : 35

NonCHAtoms : 11

Electronegative Atoms : 11

Rotatable Bond : 7

Rings Closures : 4

Small Rings : 4

Aromatic Rings : 3

Aromatic Atoms : 18

Sp3Atoms : 7

Symmetricatoms : 3

Amides : 1

StereoCon :