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C23H15NO5Cl2S | Cheminformatics
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4-[5-[(E)-3-[5-(3,4-dichlorophenyl)furan-2-yl]-3-oxoprop-1-enyl]furan-2-yl]benzenesulfonamide

Molecular Formula : C23H15NO5Cl2S | Mutagenic : high | Tumorigenic : high | Reproductive Effective : none |
4-[5-[(E)-3-[5-(3,4-dichlorophenyl)furan-2-yl]-3-oxoprop-1-enyl]furan-2-yl]benzenesulfonamide is not a drug-like molecule.

MolName : 4-[5-[(E)-3-[5-(3,4-dichlorophenyl)furan-2-yl]-3-oxoprop-1-enyl]furan-2-yl]benzenesulfonamide

MolecularFormula : C23H15NO5Cl2S

Smiles : NS(c(cc1)ccc1-c1ccc(/C=C/C(c2ccc(-c(cc3)cc(Cl)c3Cl)o2)=O)o1)(=O)=O

InChI : InChI=1S/C23H15Cl2NO5S/c24-18-8-3-15(13-19(18)25)22-11-12-23(31-22)20(27)9-4-16-5-10-21(30-16)14-1-6-17(7-2-14)32(26,28)29/h1-13H,(H2,26,28,29)

InChIK : OQARKBDOZYXLLZ-UHFFFAOYSA-N

TotalMolweight : 488.346

Molweight : 488.346

MonoisotopicMass : 487.004798

CLogP : 5.1576

CLogS : -8.131

H Acceptors : 6

H Donors : 1

TotalSurfaceArea : 344.11

Relative PSA : 0.24733

PolarSurfaceArea : 111.89

Druglikeness : 4.5417

Mutagenic : high

Tumorigenic : high

Reproductive Effective : none

Irritant : none

Nasty Functions :

Shape Index : 0.625

Fragments : 1

Non HAtoms : 32

NonCHAtoms : 9

Electronegative Atoms : 9

Rotatable Bond : 6

Rings Closures : 4

Small Rings : 4

Aromatic Rings : 4

Aromatic Atoms : 22

Sp3Atoms : 1

Symmetricatoms : 3

Amides : 1

StereoCon :

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1 - 4-[5-[(E)-3-[5-(3,4-dichlorophenyl)furan-2-yl]-3-oxoprop-1-enyl]furan-2-yl]benzenesulfonamide
2 - 4-[5-[(E)-3-[5-(3,4-dichlorophenyl)furan-2-yl]-3-oxoprop-1-enyl]furan-2-yl]benzenesulfonamide
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