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C15H9N2O2Cl2F3 | Cheminformatics
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[(Z)-(2,4-dichlorophenyl)methylideneamino] N-[4-(trifluoromethyl)phenyl]carbamate

Molecular Formula : C15H9N2O2Cl2F3 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |
[(Z)-(2,4-dichlorophenyl)methylideneamino] N-[4-(trifluoromethyl)phenyl]carbamate is not a drug-like molecule.

MolName : [(Z)-(2,4-dichlorophenyl)methylideneamino] N-[4-(trifluoromethyl)phenyl]carbamate

MolecularFormula : C15H9N2O2Cl2F3

Smiles : O=C(Nc1ccc(C(F)(F)F)cc1)O/N=C\c(ccc(Cl)c1)c1Cl

InChI : InChI=1S/C15H9Cl2F3N2O2/c16-11-4-1-9(13(17)7-11)8-21-24-14(23)22-12-5-2-10(3-6-12)15(18,19)20/h1-8H,(H,22,23)

InChIK : CBORAUOUCJXRJD-UHFFFAOYSA-N

TotalMolweight : 377.148

Molweight : 377.148

MonoisotopicMass : 375.999316

CLogP : 5.9723

CLogS : -6.537

H Acceptors : 4

H Donors : 1

TotalSurfaceArea : 257.29

Relative PSA : 0.17883

PolarSurfaceArea : 50.69

Druglikeness : -13.368

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions :

Shape Index : 0.66667

Fragments : 1

Non HAtoms : 24

NonCHAtoms : 9

Electronegative Atoms : 9

Rotatable Bond : 5

Rings Closures : 2

Small Rings : 2

Aromatic Rings : 2

Aromatic Atoms : 12

Sp3Atoms : 2

Symmetricatoms : 4

Amides : 1

StereoCon :

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