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C23H20N2O5S | Cheminformatics
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N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[(E)-2-phenylethenyl]sulfonylamino]benzamide

Molecular Formula : C23H20N2O5S | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[(E)-2-phenylethenyl]sulfonylamino]benzamide is a drug-like molecule.

MolName : N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[(E)-2-phenylethenyl]sulfonylamino]benzamide

MolecularFormula : C23H20N2O5S

Smiles : O=C(c(cccc1)c1NS(/C=C/c1ccccc1)(=O)=O)Nc(cc1)cc2c1OCCO2

InChI : InChI=1S/C23H20N2O5S/c26-23(24-18-10-11-21-22(16-18)30-14-13-29-21)19-8-4-5-9-20(19)25-31(27,28)15-12-17-6-2-1-3-7-17/h1-12,15-16,25H,13-14H2,(H,24,26)

InChIK : RFMJKGTXIYAVMD-UHFFFAOYSA-N

TotalMolweight : 436.487

Molweight : 436.487

MonoisotopicMass : 436.109293

CLogP : 3.6109

CLogS : -6.073

H Acceptors : 7

H Donors : 2

TotalSurfaceArea : 322.55

Relative PSA : 0.2621

PolarSurfaceArea : 102.11

Druglikeness : -8.6977

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions :

Shape Index : 0.58065

Fragments : 1

Non HAtoms : 31

NonCHAtoms : 8

Electronegative Atoms : 8

Rotatable Bond : 5

Rings Closures : 4

Small Rings : 4

Aromatic Rings : 3

Aromatic Atoms : 18

Sp3Atoms : 5

Symmetricatoms : 3

Amides : 2

StereoCon :

Click to Load Molecule:
1 - N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
2 - N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
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