Name: Name:Benzenepropanoic acid, β-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-4-fluoro-α-hydroxy-, (αR,βR)-rel-
Brand: Angene
SKU: AG0015WL
Rating: 90 (10 reviews)

Benzenepropanoic acid, β-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-4-fluoro-α-hydroxy-, (αR,βR)-rel-

CAS No.:

1217694-49-9

Catalog Number:

AG0015WL

Molecular Formula:

C24H20FNO5

Molecular Weight:

421.4177

Catalog Number:

AG0015WL

Chemical Name:

Benzenepropanoic acid, β-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-4-fluoro-α-hydroxy-, (αR,βR)-rel-

CAS Number:

1217694-49-9

Molecular Formula:

C24H20FNO5

Molecular Weight:

421.4177

MDL Number:

MFCD07363528

IUPAC Name:

(2R,3R)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-fluorophenyl)-2-hydroxypropanoic acid

InChI:

InChI=1S/C24H20FNO5/c25-15-11-9-14(10-12-15)21(22(27)23(28)29)26-24(30)31-13-20-18-7-3-1-5-16(18)17-6-2-4-8-19(17)20/h1-12,20-22,27H,13H2,(H,26,30)(H,28,29)/t21-,22-/m1/s1

InChI Key:

SQZGPGBZYHBPSB-FGZHOGPDSA-N

SMILES:

O=C(N[C@@H]([C@H](C(=O)O)O)c1ccc(cc1)F)OCC1c2ccccc2c2c1cccc2

Complexity:

616

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

421.133g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

421.424g/mol

Monoisotopic Mass:

421.133g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

95.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.6