methyl (4R,7S)-7-(4-fluorophenyl)-4-(furan-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate

Formula:C22H20NO4F Mutagenic:none Tumorigenic:none Reproductive Effective:none methyl (4R,7S)-7-(4-fluorophenyl)-4-(furan-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate is a drug-like molecule.

MolName	methyl (4R,7S)-7-(4-fluorophenyl)-4-(furan-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
MolecularFormula	C22H20NO4F
Smiles	CC(NC(C[C@@H](C1)c(cc2)ccc2F)=C([C@H]2c3ccco3)C1=O)=C2C(OC)=O
InChI	InChI=1S/C22H20FNO4/c1-12-19(22(26)27-2)21(18-4-3-9-28-18)20-16(24-12)10-14(11-17(20)25)13-5-7-15(23)8-6-13/h3-9,14,21,24H,10-11H2,1-2H3/t14-,21-/m0/s1
InChIK	AMKHSLABELVSIU-QKKBWIMNSA-N
TotalMolweight	381.402
Molweight	381.402
MonoisotopicMass	381.137637
CLogP	4.0404
CLogS	-4.676
H Acceptors	5
H Donors	1
TotalSurfaceArea	281.9
Relative PSA	0.21869
PolarSurfaceArea	68.54
Druglikeness	-0.94902
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	28
NonCHAtoms	6
Electronegative Atoms	6
StereoCenters	2
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	7
Symmetricatoms	2
StereoCon	this enantiomer

Click to Load Molecule:

1 - methyl (4R,7S)-7-(4-fluorophenyl)-4-(furan-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate | 2 - methyl (4R,7S)-7-(4-fluorophenyl)-4-(furan-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate

Request More Details | methyl (4R,7S)-7-(4-fluorophenyl)-4-(furan-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments