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

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

CAS No.:
1379859-26-3
Catalog Number:
AG01BKC1
Molecular Formula:
C22H20N2O4
Molecular Weight:
376.4052
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Product Description
Catalog Number:
AG01BKC1
Chemical Name:
2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-(1H-pyrrol-2-yl)propanoic acid
CAS Number:
1379859-26-3
Molecular Formula:
C22H20N2O4
Molecular Weight:
376.4052
MDL Number:
MFCD09918175
IUPAC Name:
2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(1H-pyrrol-2-yl)propanoic acid
InChI:
InChI=1S/C22H20N2O4/c25-21(26)20(12-14-6-5-11-23-14)24-22(27)28-13-19-17-9-3-1-7-15(17)16-8-2-4-10-18(16)19/h1-11,19-20,23H,12-13H2,(H,24,27)(H,25,26)
InChI Key:
DGKRTFFSECGNCF-UHFFFAOYSA-N
SMILES:
O=C(NC(C(=O)O)Cc1[nH]ccc1)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
547  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
376.142g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
376.412g/mol
Monoisotopic Mass:
376.142g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
91.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties