Name: Name:3-{3-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]phenyl}propanoic acid
Brand: Angene
SKU: AG01EKXP
Rating: 90 (10 reviews)

3-{3-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]phenyl}propanoic acid

CAS No.:

317354-98-6

Catalog Number:

AG01EKXP

Molecular Formula:

C25H23NO4

Molecular Weight:

401.4544

Catalog Number:

AG01EKXP

Chemical Name:

3-{3-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]phenyl}propanoic acid

CAS Number:

317354-98-6

Molecular Formula:

C25H23NO4

Molecular Weight:

401.4544

MDL Number:

MFCD31590466

IUPAC Name:

3-[3-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]phenyl]propanoic acid

InChI:

InChI=1S/C25H23NO4/c27-24(28)13-12-17-6-5-7-18(14-17)15-26-25(29)30-16-23-21-10-3-1-8-19(21)20-9-2-4-11-22(20)23/h1-11,14,23H,12-13,15-16H2,(H,26,29)(H,27,28)

InChI Key:

UKMIRIYZVGARDE-UHFFFAOYSA-N

SMILES:

OC(=O)CCc1cccc(c1)CNC(=O)OCC1c2ccccc2c2c1cccc2

Complexity:

572

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

401.163g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

401.462g/mol

Monoisotopic Mass:

401.163g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.3