(E)-N-[(3,5-dichloro-4-hydroxyphenyl)carbamothioyl]-3-(2,4-dichlorophenyl)prop-2-enamide

Formula:C16H10N2O2Cl4S Mutagenic:none Tumorigenic:none Reproductive Effective:high (E)-N-[(3,5-dichloro-4-hydroxyphenyl)carbamothioyl]-3-(2,4-dichlorophenyl)prop-2-enamide is not a drug-like molecule.

MolName	(E)-N-[(3,5-dichloro-4-hydroxyphenyl)carbamothioyl]-3-(2,4-dichlorophenyl)prop-2-enamide
MolecularFormula	C16H10N2O2Cl4S
Smiles	Oc(c(Cl)cc(NC(NC(/C=C/c(ccc(Cl)c1)c1Cl)=O)=S)c1)c1Cl
InChI	InChI=1S/C16H10Cl4N2O2S/c17-9-3-1-8(11(18)5-9)2-4-14(23)22-16(25)21-10-6-12(19)15(24)13(20)7-10/h1-7,24H,(H2,21,22,23,25)
InChIK	ZRXRSIUBMNFFCD-UHFFFAOYSA-N
TotalMolweight	436.145
Molweight	436.145
MonoisotopicMass	433.921706
CLogP	5.397
CLogS	-6.691
H Acceptors	4
H Donors	3
TotalSurfaceArea	300.93
Relative PSA	0.25607
PolarSurfaceArea	93.45
Druglikeness	-0.4315
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	thio-amide/urea
Shape Index	0.64
Fragments	1
Non HAtoms	25
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	3
Amides	1
StereoCon

Click to Load Molecule:

1 - (E)-N-[(3,5-dichloro-4-hydroxyphenyl)carbamothioyl]-3-(2,4-dichlorophenyl)prop-2-enamide | 2 - (E)-N-[(3,5-dichloro-4-hydroxyphenyl)carbamothioyl]-3-(2,4-dichlorophenyl)prop-2-enamide

Request More Details | (E)-N-[(3,5-dichloro-4-hydroxyphenyl)carbamothioyl]-3-(2,4-dichlorophenyl)prop-2-enamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments