Name: Name:2-(4-{[(9H-fluoren-9-yl)methoxy]carbonyl}-2-oxopiperazin-1-yl)propanoic acid
Brand: Angene
SKU: AG01EKSL
Rating: 90 (10 reviews)

2-(4-{[(9H-fluoren-9-yl)methoxy]carbonyl}-2-oxopiperazin-1-yl)propanoic acid

CAS No.:

2137493-73-1

Catalog Number:

AG01EKSL

Molecular Formula:

C22H22N2O5

Molecular Weight:

394.4205

Catalog Number:

AG01EKSL

Chemical Name:

2-(4-{[(9H-fluoren-9-yl)methoxy]carbonyl}-2-oxopiperazin-1-yl)propanoic acid

CAS Number:

2137493-73-1

Molecular Formula:

C22H22N2O5

Molecular Weight:

394.4205

MDL Number:

MFCD31558801

IUPAC Name:

2-[4-(9H-fluoren-9-ylmethoxycarbonyl)-2-oxopiperazin-1-yl]propanoic acid

InChI:

InChI=1S/C22H22N2O5/c1-14(21(26)27)24-11-10-23(12-20(24)25)22(28)29-13-19-17-8-4-2-6-15(17)16-7-3-5-9-18(16)19/h2-9,14,19H,10-13H2,1H3,(H,26,27)

InChI Key:

JYIMJNFMOJYXKD-UHFFFAOYSA-N

SMILES:

OC(=O)C(N1CCN(CC1=O)C(=O)OCC1c2ccccc2c2c1cccc2)C

Complexity:

631

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

394.153g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

394.427g/mol

Monoisotopic Mass:

394.153g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

87.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5