(5E)-3-[(4-bromophenyl)methyl]-5-[(3,5-dichloro-4-prop-2-ynoxyphenyl)methylidene]imidazolidine-2,4-dione

Formula:C20H13N2O3BrCl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5E)-3-[(4-bromophenyl)methyl]-5-[(3,5-dichloro-4-prop-2-ynoxyphenyl)methylidene]imidazolidine-2,4-dione is a drug-like molecule.

MolName	(5E)-3-[(4-bromophenyl)methyl]-5-[(3,5-dichloro-4-prop-2-ynoxyphenyl)methylidene]imidazolidine-2,4-dione
MolecularFormula	C20H13N2O3BrCl2
Smiles	C#CCOc(c(Cl)cc(/C=C(\C(N1Cc(cc2)ccc2Br)=O)/NC1=O)c1)c1Cl
InChI	InChI=1S/C20H13BrCl2N2O3/c1-2-7-28-18-15(22)8-13(9-16(18)23)10-17-19(26)25(20(27)24-17)11-12-3-5-14(21)6-4-12/h1,3-6,8-10H,7,11H2,(H,24,27)
InChIK	SVYJNNFORPKFQI-UHFFFAOYSA-N
TotalMolweight	480.144
Molweight	480.144
MonoisotopicMass	477.948658
CLogP	4.4337
CLogS	-6.645
H Acceptors	5
H Donors	1
TotalSurfaceArea	312.29
Relative PSA	0.1636
PolarSurfaceArea	58.64
Druglikeness	2.9655
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! 5-methylene-imidazolidine-2,4-dione
Shape Index	0.64286
Fragments	1
Non HAtoms	28
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	5
Amides	2
StereoCon

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1 - (5E)-3-[(4-bromophenyl)methyl]-5-[(3,5-dichloro-4-prop-2-ynoxyphenyl)methylidene]imidazolidine-2,4-dione | 2 - (5E)-3-[(4-bromophenyl)methyl]-5-[(3,5-dichloro-4-prop-2-ynoxyphenyl)methylidene]imidazolidine-2,4-dione

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