[2-(4-fluorophenyl)-2-oxoethyl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Formula:C27H20NO3FS Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-(4-fluorophenyl)-2-oxoethyl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate is not a drug-like molecule.

MolName	[2-(4-fluorophenyl)-2-oxoethyl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate
MolecularFormula	C27H20NO3FS
Smiles	O=C(COC(c1c(CCC/C2=C\c3cccs3)c2nc2ccccc12)=O)c(cc1)ccc1F
InChI	InChI=1S/C27H20FNO3S/c28-19-12-10-17(11-13-19)24(30)16-32-27(31)25-21-7-1-2-9-23(21)29-26-18(5-3-8-22(25)26)15-20-6-4-14-33-20/h1-2,4,6-7,9-15H,3,5,8,16H2
InChIK	ZZRWABYMARKHNE-UHFFFAOYSA-N
TotalMolweight	457.524
Molweight	457.524
MonoisotopicMass	457.114792
CLogP	5.5235
CLogS	-6.881
H Acceptors	4
TotalSurfaceArea	340.18
Relative PSA	0.19816
PolarSurfaceArea	84.5
Druglikeness	-0.53106
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
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	5
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

Click to Load Molecule:

1 - [2-(4-fluorophenyl)-2-oxoethyl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate | 2 - [2-(4-fluorophenyl)-2-oxoethyl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Request More Details | [2-(4-fluorophenyl)-2-oxoethyl] (4E)-4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments