2-[2-bromo-6-chloro-4-[(Z)-(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]phenoxy]acetamide

Formula:C18H13N3O4BrCl Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[2-bromo-6-chloro-4-[(Z)-(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]phenoxy]acetamide is a drug-like molecule.

MolName	2-[2-bromo-6-chloro-4-[(Z)-(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]phenoxy]acetamide
MolecularFormula	C18H13N3O4BrCl
Smiles	NC(COc(c(Cl)cc(/C=C(/C(NN1c2ccccc2)=O)\C1=O)c1)c1Br)=O
InChI	InChI=1S/C18H13BrClN3O4/c19-13-7-10(8-14(20)16(13)27-9-15(21)24)6-12-17(25)22-23(18(12)26)11-4-2-1-3-5-11/h1-8H,9H2,(H2,21,24)(H,22,25)
InChIK	HDXJAGQMUAWFHD-UHFFFAOYSA-N
TotalMolweight	450.675
Molweight	450.675
MonoisotopicMass	448.977795
CLogP	1.337
CLogS	-4.329
H Acceptors	7
H Donors	2
TotalSurfaceArea	285.57
Relative PSA	0.27804
PolarSurfaceArea	101.73
Druglikeness	2.64
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.59259
Fragments	1
Non HAtoms	27
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	2
Amides	1
StereoCon

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