2-[(Z)-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethylidene]amino]oxy-N-(3-phenoxyphenyl)acetamide

Formula:C24H21N3O6 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(Z)-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethylidene]amino]oxy-N-(3-phenoxyphenyl)acetamide is a drug-like molecule.

MolName2-[(Z)-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethylidene]amino]oxy-N-(3-phenoxyphenyl)acetamide
MolecularFormulaC24H21N3O6
SmilesO=C(CO/N=C\C(Nc(cc1)cc2c1OCCO2)=O)Nc1cc(Oc2ccccc2)ccc1
InChIInChI=1S/C24H21N3O6/c28-23(26-18-9-10-21-22(14-18)31-12-11-30-21)15-25-32-16-24(29)27-17-5-4-8-20(13-17)33-19-6-2-1-3-7-19/h1-10,13-15H,11-12,16H2,(H,26,28)(H,27,29)
InChIKNFMYNJWPDVPRNC-UHFFFAOYSA-N
TotalMolweight447.446
Molweight447.446
MonoisotopicMass447.143037
CLogP3.2158
CLogS-5.798
H Acceptors9
H Donors2
TotalSurfaceArea343.74
Relative PSA0.2924
PolarSurfaceArea107.48
Druglikeness-4.8773
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.66667
Fragments1
Non HAtoms33
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond8
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms7
Symmetricatoms2
Amides2
StereoCon

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