1-[4-({[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}methoxy)phenyl]-5-oxopyrrolidine-3-carboxamide

1-[4-({[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}methoxy)phenyl]-5-oxopyrrolidine-3-carboxamide

Formula: C20H17ClF3N3O4

SMILES: NC(=O)C1CN(C(=O)C1)C1=CC=C(OCC(=O)NC2=CC(=CC=C2Cl)C(F)(F)F)C=C1

IUPAC: 1-[4-({[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}methoxy)phenyl]-5-oxopyrrolidine-3-carboxamide

InChI: InChI=1/C20H17ClF3N3O4/c21-15-6-1-12(20(22,23)24)8-16(15)26-17(28)10-31-14-4-2-13(3-5-14)27-9-11(19(25)30)7-18(27)29/h1-6,8,11H,7,9-10H2,(H2,25,30)(H,26,28)

Composition: C (52.70%), H (3.76%), Cl (7.78%), F (12.50%), N (9.22%), O (14.04%)

Molar Mass: 455.82

Atom Count: 48

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	455.0859682
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	QONGHPGSUCHQKK-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	106.44
Topological Polar Surface Area	101.73
Polarizability	39.56
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H17ClF3N3O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00