(4-chlorophenyl)methyl N-[(E)-2-(2,4-dichlorophenyl)ethenyl]carbamate

Formula:C16H12NO2Cl3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (4-chlorophenyl)methyl N-[(E)-2-(2,4-dichlorophenyl)ethenyl]carbamate is a drug-like molecule.

MolName	(4-chlorophenyl)methyl N-[(E)-2-(2,4-dichlorophenyl)ethenyl]carbamate
MolecularFormula	C16H12NO2Cl3
Smiles	O=C(N/C=C/c(ccc(Cl)c1)c1Cl)OCc(cc1)ccc1Cl
InChI	InChI=1S/C16H12Cl3NO2/c17-13-4-1-11(2-5-13)10-22-16(21)20-8-7-12-3-6-14(18)9-15(12)19/h1-9H,10H2,(H,20,21)
InChIK	ZBOCLHXOQPAXDK-UHFFFAOYSA-N
TotalMolweight	356.635
Molweight	356.635
MonoisotopicMass	354.99336
CLogP	4.8246
CLogS	-6.319
H Acceptors	3
H Donors	1
TotalSurfaceArea	258.75
Relative PSA	0.13333
PolarSurfaceArea	38.33
Druglikeness	-9.0524
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.72727
Fragments	1
Non HAtoms	22
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	2
Amides	1
StereoCon

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