Home Carboxys 2-[1-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propyl]-1H-imidazole-4-carboxylic acid

2-[1-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propyl]-1H-imidazole-4-carboxylic acid

CAS No.:
2138507-43-2
Catalog Number:
AG01EL1S
Molecular Formula:
C22H21N3O4
Molecular Weight:
391.4198
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Product Description
Catalog Number:
AG01EL1S
Chemical Name:
2-[1-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propyl]-1H-imidazole-4-carboxylic acid
CAS Number:
2138507-43-2
Molecular Formula:
C22H21N3O4
Molecular Weight:
391.4198
MDL Number:
MFCD31615464
IUPAC Name:
2-[1-(9H-fluoren-9-ylmethoxycarbonylamino)propyl]-1H-imidazole-5-carboxylic acid
InChI:
InChI=1S/C22H21N3O4/c1-2-18(20-23-11-19(24-20)21(26)27)25-22(28)29-12-17-15-9-5-3-7-13(15)14-8-4-6-10-16(14)17/h3-11,17-18H,2,12H2,1H3,(H,23,24)(H,25,28)(H,26,27)
InChI Key:
CBDZMZWYYFCEAZ-UHFFFAOYSA-N
SMILES:
CCC(c1[nH]cc(n1)C(=O)O)NC(=O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
579  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
391.153g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
391.427g/mol
Monoisotopic Mass:
391.153g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties