Name: Name:3-(1-{[(9H-fluoren-9-yl)methoxy]carbonyl}piperidin-4-yl)-3-(4-fluorophenyl)propanoic acid
Brand: Angene
SKU: AG01EKLN
Rating: 90 (10 reviews)

3-(1-{[(9H-fluoren-9-yl)methoxy]carbonyl}piperidin-4-yl)-3-(4-fluorophenyl)propanoic acid

CAS No.:

2137546-39-3

Catalog Number:

AG01EKLN

Molecular Formula:

C29H28FNO4

Molecular Weight:

473.5353

Catalog Number:

AG01EKLN

Chemical Name:

3-(1-{[(9H-fluoren-9-yl)methoxy]carbonyl}piperidin-4-yl)-3-(4-fluorophenyl)propanoic acid

CAS Number:

2137546-39-3

Molecular Formula:

C29H28FNO4

Molecular Weight:

473.5353

MDL Number:

MFCD31615473

IUPAC Name:

3-[1-(9H-fluoren-9-ylmethoxycarbonyl)piperidin-4-yl]-3-(4-fluorophenyl)propanoic acid

InChI:

InChI=1S/C29H28FNO4/c30-21-11-9-19(10-12-21)26(17-28(32)33)20-13-15-31(16-14-20)29(34)35-18-27-24-7-3-1-5-22(24)23-6-2-4-8-25(23)27/h1-12,20,26-27H,13-18H2,(H,32,33)

InChI Key:

ZKOKEDHXCMCMKB-UHFFFAOYSA-N

SMILES:

OC(=O)CC(c1ccc(cc1)F)C1CCN(CC1)C(=O)OCC1c2ccccc2c2c1cccc2

Complexity:

708

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

473.2g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

473.544g/mol

Monoisotopic Mass:

473.2g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

5.3