2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(Z)-(4-phenylphenyl)methylideneamino]acetamide

Formula:C22H17N3OS2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(Z)-(4-phenylphenyl)methylideneamino]acetamide is not a drug-like molecule.

MolName	2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(Z)-(4-phenylphenyl)methylideneamino]acetamide
MolecularFormula	C22H17N3OS2
Smiles	O=C(CSc1nc(cccc2)c2s1)N/N=C\c(cc1)ccc1-c1ccccc1
InChI	InChI=1S/C22H17N3OS2/c26-21(15-27-22-24-19-8-4-5-9-20(19)28-22)25-23-14-16-10-12-18(13-11-16)17-6-2-1-3-7-17/h1-14H,15H2,(H,25,26)
InChIK	VFMPELOUSDFLSC-UHFFFAOYSA-N
TotalMolweight	403.529
Molweight	403.529
MonoisotopicMass	403.081302
CLogP	5.5755
CLogS	-7.185
H Acceptors	4
H Donors	1
TotalSurfaceArea	307.3
Relative PSA	0.27605
PolarSurfaceArea	107.89
Druglikeness	4.7928
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.67857
Fragments	1
Non HAtoms	28
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	2
Symmetricatoms	4
Aromatic Nitrogens	1
StereoCon

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