2-[(2-bromophenyl)methylsulfanyl]-N-[(Z)-furan-2-ylmethylideneamino]acetamide

Formula:C14H13N2O2BrS Mutagenic:high Tumorigenic:none Reproductive Effective:none 2-[(2-bromophenyl)methylsulfanyl]-N-[(Z)-furan-2-ylmethylideneamino]acetamide is a drug-like molecule.

MolName	2-[(2-bromophenyl)methylsulfanyl]-N-[(Z)-furan-2-ylmethylideneamino]acetamide
MolecularFormula	C14H13N2O2BrS
Smiles	O=C(CSCc(cccc1)c1Br)N/N=C\c1ccco1
InChI	InChI=1S/C14H13BrN2O2S/c15-13-6-2-1-4-11(13)9-20-10-14(18)17-16-8-12-5-3-7-19-12/h1-8H,9-10H2,(H,17,18)
InChIK	WMHUCQFTSVPQPY-UHFFFAOYSA-N
TotalMolweight	353.239
Molweight	353.239
MonoisotopicMass	351.988109
CLogP	3.3051
CLogS	-5.023
H Acceptors	4
H Donors	1
TotalSurfaceArea	240.32
Relative PSA	0.28133
PolarSurfaceArea	79.9
Druglikeness	2.7732
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.7
Fragments	1
Non HAtoms	20
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	3
StereoCon

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