2-[2-[(E)-[1-(3-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetamide

Formula:C19H14N3O5Cl Mutagenic:none Tumorigenic:none Reproductive Effective:high 2-[2-[(E)-[1-(3-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetamide is a drug-like molecule.

MolName	2-[2-[(E)-[1-(3-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetamide
MolecularFormula	C19H14N3O5Cl
Smiles	NC(COc1c(/C=C(\C(NC(N2c3cccc(Cl)c3)=O)=O)/C2=O)cccc1)=O
InChI	InChI=1S/C19H14ClN3O5/c20-12-5-3-6-13(9-12)23-18(26)14(17(25)22-19(23)27)8-11-4-1-2-7-15(11)28-10-16(21)24/h1-9H,10H2,(H2,21,24)(H,22,25,27)
InChIK	UYCQDHLQAFSMLW-UHFFFAOYSA-N
TotalMolweight	399.789
Molweight	399.789
MonoisotopicMass	399.062199
CLogP	1.4236
CLogS	-4.492
H Acceptors	8
H Donors	2
TotalSurfaceArea	284.69
Relative PSA	0.3247
PolarSurfaceArea	118.8
Druglikeness	5.1492
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.5
Fragments	1
Non HAtoms	28
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Amides	3
StereoCon

Click to Load Molecule:

1 - 2-[2-[(E)-[1-(3-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetamide | 2 - 2-[2-[(E)-[1-(3-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetamide

Request More Details | 2-[2-[(E)-[1-(3-chlorophenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]phenoxy]acetamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments