2-(3-methoxyphenyl)-2-oxoethyl 4-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}butanoate

2-(3-methoxyphenyl)-2-oxoethyl 4-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}butanoate

Formula: C21H19ClF3NO5

SMILES: COC1=CC=CC(=C1)C(=O)COC(=O)CCCC(=O)NC1=CC(=CC=C1Cl)C(F)(F)F

IUPAC: 2-(3-methoxyphenyl)-2-oxoethyl 4-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}butanoate

InChI: InChI=1S/C21H19ClF3NO5/c1-30-15-5-2-4-13(10-15)18(27)12-31-20(29)7-3-6-19(28)26-17-11-14(21(23,24)25)8-9-16(17)22/h2,4-5,8-11H,3,6-7,12H2,1H3,(H,26,28)

Composition: C (55.09%), H (4.18%), Cl (7.74%), F (12.45%), N (3.06%), O (17.47%)

Molar Mass: 457.83

Atom Count: 50

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	457.0903849
Formal Charge	0
FSP3	0.29
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	DOTZZCCEXMFHNS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	108.33
Topological Polar Surface Area	81.7
Polarizability	40.49
Ring Count	2
Rotatable Bond Count	11

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H19ClF3NO5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00