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C24H26N3O (Z)-N-(4-benzylpiperazin-4-ium-1-yl)-1-(3-phenoxyphenyl)methanimine | Chemryt

(Z)-N-(4-benzylpiperazin-4-ium-1-yl)-1-(3-phenoxyphenyl)methanimine

Molecular Formula : C24H26N3O | Mutagenic : none | Tumorigenic : none | Reproductive Effective : |

MolName : (Z)-N-(4-benzylpiperazin-4-ium-1-yl)-1-(3-phenoxyphenyl)methanimine

MolecularFormula : C24H26N3O

Smiles : C(c1ccccc1)[NH+](CC1)CCN1/N=C\c1cccc(Oc2ccccc2)c1

InChI : InChI=1S/C24H25N3O/c1-3-8-21(9-4-1)20-26-14-16-27(17-15-26)25-19-22-10-7-13-24(18-22)28-23-11-5-2-6-12-23/h1-13,18-19H,14-17,20H2/p+1

InChIK : NACDIMVLKYHRRO-UHFFFAOYSA-O

TotalMolweight : 372.49

Molweight : 372.49

MonoisotopicMass : 372.207587

CLogP : 2.3049

CLogS : -4.953

H Acceptors : 4

H Donors : 1

TotalSurfaceArea : 317.48

Relative PSA : 0.13434

PolarSurfaceArea : 29.27

Druglikeness : 3.5777

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions : imine/hydrazone of aldehyde

Shape Index : 0.67857

Fragments : 1

Non HAtoms : 28

NonCHAtoms : 4

Electronegative Atoms : 4

Rotatable Bond : 6

Rings Closures : 4

Small Rings : 4

Aromatic Rings : 3

Aromatic Atoms : 18

Sp3Atoms : 8

Symmetricatoms : 6

Amines : 1

AlkylAmines : 1

BasicNitrogens : 1

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