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MolName : N-[(Z)-[2-[(4-bromophenyl)methoxy]phenyl]methylideneamino]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide

MolecularFormula : C24H21N2O4Br

Smiles : O=C(Cc(cc1)cc2c1OCCO2)N/N=C\c(cccc1)c1OCc(cc1)ccc1Br

InChI : InChI=1S/C24H21BrN2O4/c25-20-8-5-17(6-9-20)16-31-21-4-2-1-3-19(21)15-26-27-24(28)14-18-7-10-22-23(13-18)30-12-11-29-22/h1-10,13,15H,11-12,14,16H2,(H,27,28)

InChIK : HIRMUFCJYQGWCS-UHFFFAOYSA-N

TotalMolweight : 481.345

Molweight : 481.345

MonoisotopicMass : 480.068469

CLogP : 5.2518

CLogS : -6.043

H Acceptors : 6

H Donors : 1

TotalSurfaceArea : 336.92

Relative PSA : 0.19592

PolarSurfaceArea : 69.15

Druglikeness : -4.6614

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

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

Shape Index : 0.64516

Fragments : 1

Non HAtoms : 31

NonCHAtoms : 7

Electronegative Atoms : 7

Rotatable Bond : 7

Rings Closures : 4

Small Rings : 4

Aromatic Rings : 3

Aromatic Atoms : 18

Sp3Atoms : 7

Symmetricatoms : 2

StereoCon :