Home Carboxys 3-carbamoylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid

3-carbamoylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid

CAS No.:
1424612-37-2
Catalog Number:
AG01A1H0
Molecular Formula:
C8H6N4O3
Molecular Weight:
206.1582
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Product Description
Catalog Number:
AG01A1H0
Chemical Name:
3-carbamoylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
CAS Number:
1424612-37-2
Molecular Formula:
C8H6N4O3
Molecular Weight:
206.1582
MDL Number:
MFCD23701774
IUPAC Name:
3-carbamoylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
InChI:
InChI=1S/C8H6N4O3/c9-6(13)4-3-11-12-5(8(14)15)1-2-10-7(4)12/h1-3H,(H2,9,13)(H,14,15)
InChI Key:
UCSHYAPSHZJSEA-UHFFFAOYSA-N
SMILES:
NC(=O)c1cnn2c1nccc2C(=O)O
Properties
Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.044g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
206.161g/mol
Monoisotopic Mass:
206.044g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  
Properties