1-[2-[(2E)-2-[(2-fluorophenyl)methylidene]-3-oxo-1,4-benzoxazin-4-yl]acetyl]piperidine-4-carboxamide

Formula:C23H22N3O4F Mutagenic:none Tumorigenic:none Reproductive Effective:low 1-[2-[(2E)-2-[(2-fluorophenyl)methylidene]-3-oxo-1,4-benzoxazin-4-yl]acetyl]piperidine-4-carboxamide is a drug-like molecule.

MolName	1-[2-[(2E)-2-[(2-fluorophenyl)methylidene]-3-oxo-1,4-benzoxazin-4-yl]acetyl]piperidine-4-carboxamide
MolecularFormula	C23H22N3O4F
Smiles	NC(C(CC1)CCN1C(CN(c(cccc1)c1O/C1=C/c(cccc2)c2F)C1=O)=O)=O
InChI	InChI=1S/C23H22FN3O4/c24-17-6-2-1-5-16(17)13-20-23(30)27(18-7-3-4-8-19(18)31-20)14-21(28)26-11-9-15(10-12-26)22(25)29/h1-8,13,15H,9-12,14H2,(H2,25,29)
InChIK	FIOUWBCKTPFSII-UHFFFAOYSA-N
TotalMolweight	423.443
Molweight	423.443
MonoisotopicMass	423.159435
CLogP	2.0434
CLogS	-4.162
H Acceptors	7
H Donors	1
TotalSurfaceArea	310.75
Relative PSA	0.23006
PolarSurfaceArea	92.94
Druglikeness	4.7582
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.51613
Fragments	1
Non HAtoms	31
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	7
Symmetricatoms	2
Amides	3
StereoCon

Click to Load Molecule:

1 - 1-[2-[(2E)-2-[(2-fluorophenyl)methylidene]-3-oxo-1,4-benzoxazin-4-yl]acetyl]piperidine-4-carboxamide | 2 - 1-[2-[(2E)-2-[(2-fluorophenyl)methylidene]-3-oxo-1,4-benzoxazin-4-yl]acetyl]piperidine-4-carboxamide

Request More Details | 1-[2-[(2E)-2-[(2-fluorophenyl)methylidene]-3-oxo-1,4-benzoxazin-4-yl]acetyl]piperidine-4-carboxamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments