Name: Name:2-({[(9H-fluoren-9-yl)methoxy]carbonyl}(methyl)amino)-2-(3,4,5-trifluorophenyl)acetic acid
Brand: Angene
SKU: AG01EKC9
Rating: 90 (10 reviews)

2-({[(9H-fluoren-9-yl)methoxy]carbonyl}(methyl)amino)-2-(3,4,5-trifluorophenyl)acetic acid

CAS No.:

1692111-81-1

Catalog Number:

AG01EKC9

Molecular Formula:

C24H18F3NO4

Molecular Weight:

441.3992

Catalog Number:

AG01EKC9

Chemical Name:

2-({[(9H-fluoren-9-yl)methoxy]carbonyl}(methyl)amino)-2-(3,4,5-trifluorophenyl)acetic acid

CAS Number:

1692111-81-1

Molecular Formula:

C24H18F3NO4

Molecular Weight:

441.3992

MDL Number:

MFCD31664999

IUPAC Name:

2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]-2-(3,4,5-trifluorophenyl)acetic acid

InChI:

InChI=1S/C24H18F3NO4/c1-28(22(23(29)30)13-10-19(25)21(27)20(26)11-13)24(31)32-12-18-16-8-4-2-6-14(16)15-7-3-5-9-17(15)18/h2-11,18,22H,12H2,1H3,(H,29,30)

InChI Key:

NFDDIWZNBMUKCK-UHFFFAOYSA-N

SMILES:

OC(=O)C(N(C(=O)OCC1c2ccccc2c2c1cccc2)C)c1cc(F)c(c(c1)F)F

Complexity:

660

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

441.119g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

441.406g/mol

Monoisotopic Mass:

441.119g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.8