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C23H10NO2Cl4F3 | Cheminformatics
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(5Z)-4-(4-chlorophenyl)-3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-5-[(2,4-dichlorophenyl)methylidene]furan-2-one

Molecular Formula : C23H10NO2Cl4F3 | Mutagenic : none | Tumorigenic : high | Reproductive Effective : low |
(5Z)-4-(4-chlorophenyl)-3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-5-[(2,4-dichlorophenyl)methylidene]furan-2-one is not a drug-like molecule.

MolName : (5Z)-4-(4-chlorophenyl)-3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-5-[(2,4-dichlorophenyl)methylidene]furan-2-one

MolecularFormula : C23H10NO2Cl4F3

Smiles : O=C(C(c(ncc(C(F)(F)F)c1)c1Cl)=C1c(cc2)ccc2Cl)O/C1=C\c(ccc(Cl)c1)c1Cl

InChI : InChI=1S/C23H10Cl4F3NO2/c24-14-4-1-11(2-5-14)19-18(7-12-3-6-15(25)9-16(12)26)33-22(32)20(19)21-17(27)8-13(10-31-21)23(28,29)30/h1-10H

InChIK : UTRWRUSGOFIMNX-UHFFFAOYSA-N

TotalMolweight : 531.143

Molweight : 531.143

MonoisotopicMass : 528.941771

CLogP : 6.5242

CLogS : -7.588

H Acceptors : 3

TotalSurfaceArea : 344.56

Relative PSA : 0.098706

PolarSurfaceArea : 39.19

Druglikeness : -7.0387

Mutagenic : none

Tumorigenic : high

Reproductive Effective : low

Irritant : high

Nasty Functions :

Shape Index : 0.45455

Fragments : 1

Non HAtoms : 33

NonCHAtoms : 10

Electronegative Atoms : 10

Rotatable Bond : 4

Rings Closures : 4

Small Rings : 4

Aromatic Rings : 3

Aromatic Atoms : 18

Sp3Atoms : 2

Symmetricatoms : 4

Aromatic Nitrogens : 1

StereoCon :

Click to Load Molecule:
1 - (5Z)-4-(4-chlorophenyl)-3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-5-[(2,4-dichlorophenyl)methylidene]furan-2-one
2 - (5Z)-4-(4-chlorophenyl)-3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-5-[(2,4-dichlorophenyl)methylidene]furan-2-one
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