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C17H18N2O3S | Cheminformatics

(NE)-N-[morpholin-4-yl(phenyl)methylidene]benzenesulfonamide

Molecular Formula : C17H18N2O3S | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |
(NE)-N-[morpholin-4-yl(phenyl)methylidene]benzenesulfonamide is a drug-like molecule.

MolName : (NE)-N-[morpholin-4-yl(phenyl)methylidene]benzenesulfonamide

MolecularFormula : C17H18N2O3S

Smiles : O=S(c1ccccc1)(/N=C(\c1ccccc1)/N1CCOCC1)=O

InChI : InChI=1S/C17H18N2O3S/c20-23(21,16-9-5-2-6-10-16)18-17(15-7-3-1-4-8-15)19-11-13-22-14-12-19/h1-10H,11-14H2

InChIK : CCUWHLGKFFJENY-UHFFFAOYSA-N

TotalMolweight : 330.407

Molweight : 330.407

MonoisotopicMass : 330.103813

CLogP : 2.5365

CLogS : -2.418

H Acceptors : 5

TotalSurfaceArea : 246.41

Relative PSA : 0.21769

PolarSurfaceArea : 67.35

Druglikeness : -4.58

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions :

Shape Index : 0.47826

Fragments : 1

Non HAtoms : 23

NonCHAtoms : 6

Electronegative Atoms : 6

Rotatable Bond : 2

Rings Closures : 3

Small Rings : 3

Aromatic Rings : 2

Aromatic Atoms : 12

Sp3Atoms : 6

Symmetricatoms : 7

BasicNitrogens : 1

StereoCon :

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