Home Other Building Blocks 2-(4-sulfamoyl-1H-pyrazol-1-yl)acetic acid

2-(4-sulfamoyl-1H-pyrazol-1-yl)acetic acid

CAS No.:
1153401-02-5
Catalog Number:
AG01A825
Molecular Formula:
C5H7N3O4S
Molecular Weight:
205.1918
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Product Description
Catalog Number:
AG01A825
Chemical Name:
2-(4-sulfamoyl-1H-pyrazol-1-yl)acetic acid
CAS Number:
1153401-02-5
Molecular Formula:
C5H7N3O4S
Molecular Weight:
205.1918
MDL Number:
MFCD12187432
IUPAC Name:
2-(4-sulfamoylpyrazol-1-yl)acetic acid
InChI:
InChI=1S/C5H7N3O4S/c6-13(11,12)4-1-7-8(2-4)3-5(9)10/h1-2H,3H2,(H,9,10)(H2,6,11,12)
InChI Key:
MELFTMQIKRPKGQ-UHFFFAOYSA-N
SMILES:
OC(=O)Cn1ncc(c1)S(=O)(=O)N
Properties
Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.016g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
205.188g/mol
Monoisotopic Mass:
205.016g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5  
Properties