Home Carboxys 5-{[(9H-fluoren-9-yl)methoxy]carbonyl}-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-3-carboxylic acid

5-{[(9H-fluoren-9-yl)methoxy]carbonyl}-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-3-carboxylic acid

CAS No.:
2138424-73-2
Catalog Number:
AG01EKZZ
Molecular Formula:
C22H19N3O4
Molecular Weight:
389.4040
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Product Description
Catalog Number:
AG01EKZZ
Chemical Name:
5-{[(9H-fluoren-9-yl)methoxy]carbonyl}-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-3-carboxylic acid
CAS Number:
2138424-73-2
Molecular Formula:
C22H19N3O4
Molecular Weight:
389.4040
MDL Number:
MFCD31601825
IUPAC Name:
5-(9H-fluoren-9-ylmethoxycarbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-3-carboxylic acid
InChI:
InChI=1S/C22H19N3O4/c26-21(27)18-11-23-25-10-9-24(12-20(18)25)22(28)29-13-19-16-7-3-1-5-14(16)15-6-2-4-8-17(15)19/h1-8,11,19H,9-10,12-13H2,(H,26,27)
InChI Key:
IRRYSNUFKVODSW-UHFFFAOYSA-N
SMILES:
O=C(N1CCn2c(C1)c(cn2)C(=O)O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
622  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
389.138g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
389.411g/mol
Monoisotopic Mass:
389.138g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties