(5E)-1-(3,4-dichlorophenyl)-5-[(4-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

Formula:C17H10N2O4Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:high (5E)-1-(3,4-dichlorophenyl)-5-[(4-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5E)-1-(3,4-dichlorophenyl)-5-[(4-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
MolecularFormula	C17H10N2O4Cl2
Smiles	Oc1ccc(/C=C(\C(NC(N2c(cc3)cc(Cl)c3Cl)=O)=O)/C2=O)cc1
InChI	InChI=1S/C17H10Cl2N2O4/c18-13-6-3-10(8-14(13)19)21-16(24)12(15(23)20-17(21)25)7-9-1-4-11(22)5-2-9/h1-8,22H,(H,20,23,25)
InChIK	VRLOYLVADJJYMF-UHFFFAOYSA-N
TotalMolweight	377.182
Molweight	377.182
MonoisotopicMass	376.001762
CLogP	3.0217
CLogS	-5.063
H Acceptors	6
H Donors	2
TotalSurfaceArea	256.43
Relative PSA	0.26218
PolarSurfaceArea	86.71
Druglikeness	4.7611
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.56
Fragments	1
Non HAtoms	25
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	2
Amides	2
StereoCon

Click to Load Molecule:

1 - (5E)-1-(3,4-dichlorophenyl)-5-[(4-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione | 2 - (5E)-1-(3,4-dichlorophenyl)-5-[(4-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

Request More Details | (5E)-1-(3,4-dichlorophenyl)-5-[(4-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments