Name: Name:2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-(1H-pyrrol-1-yl)propanoic acid
Brand: Angene
SKU: AG01EL1W
Rating: 90 (10 reviews)

2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-(1H-pyrrol-1-yl)propanoic acid

CAS No.:

2137512-97-9

Catalog Number:

AG01EL1W

Molecular Formula:

C22H20N2O4

Molecular Weight:

376.4052

Catalog Number:

AG01EL1W

Chemical Name:

2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-(1H-pyrrol-1-yl)propanoic acid

CAS Number:

2137512-97-9

Molecular Formula:

C22H20N2O4

Molecular Weight:

376.4052

MDL Number:

MFCD31558749

IUPAC Name:

2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-pyrrol-1-ylpropanoic acid

InChI:

InChI=1S/C22H20N2O4/c25-21(26)20(13-24-11-5-6-12-24)23-22(27)28-14-19-17-9-3-1-7-15(17)16-8-2-4-10-18(16)19/h1-12,19-20H,13-14H2,(H,23,27)(H,25,26)

InChI Key:

JOMKLUODADXTIR-UHFFFAOYSA-N

SMILES:

O=C(NC(C(=O)O)Cn1cccc1)OCC1c2ccccc2c2c1cccc2

Complexity:

541

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

376.142g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

376.412g/mol

Monoisotopic Mass:

376.142g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1