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C14H15N5O3Cl2 | Cheminformatics
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4-[(Z)-N-[(2,4-dichlorophenyl)methoxy]-C-morpholin-4-ylcarbonimidoyl]-1,2,5-oxadiazol-3-amine

Molecular Formula : C14H15N5O3Cl2 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |
4-[(Z)-N-[(2,4-dichlorophenyl)methoxy]-C-morpholin-4-ylcarbonimidoyl]-1,2,5-oxadiazol-3-amine is a drug-like molecule.

MolName : 4-[(Z)-N-[(2,4-dichlorophenyl)methoxy]-C-morpholin-4-ylcarbonimidoyl]-1,2,5-oxadiazol-3-amine

MolecularFormula : C14H15N5O3Cl2

Smiles : Nc1nonc1/C(/N1CCOCC1)=N/OCc(ccc(Cl)c1)c1Cl

InChI : InChI=1S/C14H15Cl2N5O3/c15-10-2-1-9(11(16)7-10)8-23-20-14(12-13(17)19-24-18-12)21-3-5-22-6-4-21/h1-2,7H,3-6,8H2,(H2,17,19)

InChIK : XFFXMKUGMYGWBR-UHFFFAOYSA-N

TotalMolweight : 372.211

Molweight : 372.211

MonoisotopicMass : 371.055194

CLogP : 3.0281

CLogS : -3.368

H Acceptors : 8

H Donors : 1

TotalSurfaceArea : 268.16

Relative PSA : 0.32212

PolarSurfaceArea : 99

Druglikeness : 2.9987

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions :

Shape Index : 0.54167

Fragments : 1

Non HAtoms : 24

NonCHAtoms : 10

Electronegative Atoms : 10

Rotatable Bond : 4

Rings Closures : 3

Small Rings : 3

Aromatic Rings : 2

Aromatic Atoms : 11

Sp3Atoms : 7

Symmetricatoms : 2

Aromatic Nitrogens : 2

StereoCon :

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1 - 4-[(Z)-N-[(2,4-dichlorophenyl)methoxy]-C-morpholin-4-ylcarbonimidoyl]-1,2,5-oxadiazol-3-amine
2 - 4-[(Z)-N-[(2,4-dichlorophenyl)methoxy]-C-morpholin-4-ylcarbonimidoyl]-1,2,5-oxadiazol-3-amine
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