2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]acetamide

Formula:C23H19N3O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]acetamide is not a drug-like molecule.

MolName	2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]acetamide
MolecularFormula	C23H19N3O3S
Smiles	O=C(CSc1nc(cccc2)c2o1)N/N=C\c1cc(OCc2ccccc2)ccc1
InChI	InChI=1S/C23H19N3O3S/c27-22(16-30-23-25-20-11-4-5-12-21(20)29-23)26-24-14-18-9-6-10-19(13-18)28-15-17-7-2-1-3-8-17/h1-14H,15-16H2,(H,26,27)
InChIK	CHOWCSOSEPIVHY-UHFFFAOYSA-N
TotalMolweight	417.488
Molweight	417.488
MonoisotopicMass	417.114712
CLogP	5.0164
CLogS	-6.218
H Acceptors	6
H Donors	1
TotalSurfaceArea	324.81
Relative PSA	0.27271
PolarSurfaceArea	102.02
Druglikeness	4.4451
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.66667
Fragments	1
Non HAtoms	30
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	4
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

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