(E)-N-[2-[4-(4-fluorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-3-phenyl-N-prop-2-enylprop-2-enamide

Formula:C27H25N2O2FS Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-[2-[4-(4-fluorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-3-phenyl-N-prop-2-enylprop-2-enamide is not a drug-like molecule.

MolName	(E)-N-[2-[4-(4-fluorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-3-phenyl-N-prop-2-enylprop-2-enamide
MolecularFormula	C27H25N2O2FS
Smiles	C=CCN(CC(N(CCc1c2ccs1)C2c(cc1)ccc1F)=O)C(/C=C/c1ccccc1)=O
InChI	InChI=1S/C27H25FN2O2S/c1-2-16-29(25(31)13-8-20-6-4-3-5-7-20)19-26(32)30-17-14-24-23(15-18-33-24)27(30)21-9-11-22(28)12-10-21/h2-13,15,18,27H,1,14,16-17,19H2/t27-/m1/s1
InChIK	ZDQLZMUKGPKFNL-HHHXNRCGSA-N
TotalMolweight	460.572
Molweight	460.572
MonoisotopicMass	460.162076
CLogP	5.329
CLogS	-4.799
H Acceptors	4
TotalSurfaceArea	356.25
Relative PSA	0.15029
PolarSurfaceArea	68.86
Druglikeness	0.04195
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51515
Fragments	1
Non HAtoms	33
NonCHAtoms	6
Electronegative Atoms	6
StereoCenters	1
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	5
Symmetricatoms	4
Amides	2
StereoCon	racemate

Click to Load Molecule:

1 - (E)-N-[2-[4-(4-fluorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-3-phenyl-N-prop-2-enylprop-2-enamide | 2 - (E)-N-[2-[4-(4-fluorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-3-phenyl-N-prop-2-enylprop-2-enamide

Request More Details | (E)-N-[2-[4-(4-fluorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-3-phenyl-N-prop-2-enylprop-2-enamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments