2-[2-bromo-4-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]-N-phenylacetamide

Formula:C18H13N2O3BrS2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[2-bromo-4-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]-N-phenylacetamide is a drug-like molecule.

MolName	2-[2-bromo-4-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]-N-phenylacetamide
MolecularFormula	C18H13N2O3BrS2
Smiles	O=C(COc(ccc(/C=C(/C(N1)=O)\SC1=S)c1)c1Br)Nc1ccccc1
InChI	InChI=1S/C18H13BrN2O3S2/c19-13-8-11(9-15-17(23)21-18(25)26-15)6-7-14(13)24-10-16(22)20-12-4-2-1-3-5-12/h1-9H,10H2,(H,20,22)(H,21,23,25)
InChIK	CENYQJZXUOUMHC-UHFFFAOYSA-N
TotalMolweight	449.348
Molweight	449.348
MonoisotopicMass	447.955094
CLogP	2.5918
CLogS	-5.626
H Acceptors	5
H Donors	2
TotalSurfaceArea	295.24
Relative PSA	0.35392
PolarSurfaceArea	124.82
Druglikeness	0.59123
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.65385
Fragments	1
Non HAtoms	26
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	2
Amides	2
StereoCon

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