(E)-N-[[(2,2-diphenylacetyl)amino]carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide

Formula:C24H20N3O2FS Mutagenic:high Tumorigenic:none Reproductive Effective:high (E)-N-[[(2,2-diphenylacetyl)amino]carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide is a drug-like molecule.

MolName	(E)-N-[[(2,2-diphenylacetyl)amino]carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide
MolecularFormula	C24H20N3O2FS
Smiles	O=C(C(c1ccccc1)c1ccccc1)NNC(NC(/C=C/c(cc1)ccc1F)=O)=S
InChI	InChI=1S/C24H20FN3O2S/c25-20-14-11-17(12-15-20)13-16-21(29)26-24(31)28-27-23(30)22(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-16,22H,(H,27,30)(H2,26,28,29,31)
InChIK	OXSWLMDTTPKEIF-UHFFFAOYSA-N
TotalMolweight	433.506
Molweight	433.506
MonoisotopicMass	433.126025
CLogP	3.7557
CLogS	-5.653
H Acceptors	5
H Donors	3
TotalSurfaceArea	340.72
Relative PSA	0.25963
PolarSurfaceArea	102.32
Druglikeness	0.55139
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	thio-amide/urea
Shape Index	0.58065
Fragments	1
Non HAtoms	31
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	10
Amides	1
StereoCon

Click to Load Molecule:

1 - (E)-N-[[(2,2-diphenylacetyl)amino]carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide | 2 - (E)-N-[[(2,2-diphenylacetyl)amino]carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide

Request More Details | (E)-N-[[(2,2-diphenylacetyl)amino]carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments