Home Carboxys 4-(3-oxopiperazin-1-yl)pyridine-2-carboxylic acid hydrochloride

4-(3-oxopiperazin-1-yl)pyridine-2-carboxylic acid hydrochloride

CAS No.:
1797548-50-5
Catalog Number:
AG01AG9P
Molecular Formula:
C10H12ClN3O3
Molecular Weight:
257.6736
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Product Description
Catalog Number:
AG01AG9P
Chemical Name:
4-(3-oxopiperazin-1-yl)pyridine-2-carboxylic acid hydrochloride
CAS Number:
1797548-50-5
Molecular Formula:
C10H12ClN3O3
Molecular Weight:
257.6736
MDL Number:
MFCD27980689
IUPAC Name:
4-(3-oxopiperazin-1-yl)pyridine-2-carboxylic acid;hydrochloride
InChI:
InChI=1S/C10H11N3O3.ClH/c14-9-6-13(4-3-12-9)7-1-2-11-8(5-7)10(15)16;/h1-2,5H,3-4,6H2,(H,12,14)(H,15,16);1H
InChI Key:
FFRPWJOISCOURO-UHFFFAOYSA-N
SMILES:
O=C1NCCN(C1)c1ccnc(c1)C(=O)O.Cl
Properties
Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.057g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
257.674g/mol
Monoisotopic Mass:
257.057g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
82.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties