Name: Name:2-(ETHOXYCARBONYLMETHYL)-3'-(TRIFLUOROMETHYLNICOTINANILIDE)
Brand: Angene
SKU: AG00C831
Rating: 90 (10 reviews)

2-(ETHOXYCARBONYLMETHYL)-3'-(TRIFLUOROMETHYLNICOTINANILIDE)

CAS No.:

338392-12-4

Catalog Number:

AG00C831

Molecular Formula:

C17H15F3N2O3

Molecular Weight:

352.3078

Catalog Number:

AG00C831

Chemical Name:

2-(ETHOXYCARBONYLMETHYL)-3'-(TRIFLUOROMETHYLNICOTINANILIDE)

CAS Number:

338392-12-4

Molecular Formula:

C17H15F3N2O3

Molecular Weight:

352.3078

MDL Number:

MFCD00974992

IUPAC Name:

ethyl 2-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]pyridin-2-yl]acetate

InChI:

InChI=1S/C17H15F3N2O3/c1-2-25-15(23)10-14-13(7-4-8-21-14)16(24)22-12-6-3-5-11(9-12)17(18,19)20/h3-9H,2,10H2,1H3,(H,22,24)

InChI Key:

QAQMFPSVVOFUNB-UHFFFAOYSA-N

SMILES:

CCOC(=O)Cc1ncccc1C(=O)Nc1cccc(c1)C(F)(F)F

Complexity:

471

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

352.103g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

352.313g/mol

Monoisotopic Mass:

352.103g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8