(E)-3-phenyl-N-[[[2-(2-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide

Formula:C24H21N3O3S Mutagenic:high Tumorigenic:none Reproductive Effective:high (E)-3-phenyl-N-[[[2-(2-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide is a drug-like molecule.

MolName	(E)-3-phenyl-N-[[[2-(2-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide
MolecularFormula	C24H21N3O3S
Smiles	O=C(COc(cccc1)c1-c1ccccc1)NNC(NC(/C=C/c1ccccc1)=O)=S
InChI	InChI=1S/C24H21N3O3S/c28-22(16-15-18-9-3-1-4-10-18)25-24(31)27-26-23(29)17-30-21-14-8-7-13-20(21)19-11-5-2-6-12-19/h1-16H,17H2,(H,26,29)(H2,25,27,28,31)
InChIK	AACXVXLRZFHTFU-UHFFFAOYSA-N
TotalMolweight	431.515
Molweight	431.515
MonoisotopicMass	431.130362
CLogP	3.3633
CLogS	-6.091
H Acceptors	6
H Donors	3
TotalSurfaceArea	345.63
Relative PSA	0.28487
PolarSurfaceArea	111.55
Druglikeness	1.1197
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	thio-amide/urea
Shape Index	0.64516
Fragments	1
Non HAtoms	31
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	4
Amides	1
StereoCon

Click to Load Molecule:

1 - (E)-3-phenyl-N-[[[2-(2-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide | 2 - (E)-3-phenyl-N-[[[2-(2-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide

Request More Details | (E)-3-phenyl-N-[[[2-(2-phenylphenoxy)acetyl]amino]carbamothioyl]prop-2-enamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments