Home Carboxys Imidazo[1,5-c]pyrimidine-7-carboxylic acid, 5,6,7,8-tetrahydro-5-oxo-, monohydrochloride, (S)- (9CI)

Imidazo[1,5-c]pyrimidine-7-carboxylic acid, 5,6,7,8-tetrahydro-5-oxo-, monohydrochloride, (S)- (9CI)

CAS No.:
151112-05-9
Catalog Number:
AG001N3Q
Molecular Formula:
C7H8ClN3O3
Molecular Weight:
217.6097
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Product Description
Catalog Number:
AG001N3Q
Chemical Name:
Imidazo[1,5-c]pyrimidine-7-carboxylic acid, 5,6,7,8-tetrahydro-5-oxo-, monohydrochloride, (S)- (9CI)
CAS Number:
151112-05-9
Molecular Formula:
C7H8ClN3O3
Molecular Weight:
217.6097
MDL Number:
MFCD31629267
IUPAC Name:
(7S)-5-oxo-7,8-dihydro-6H-imidazo[1,5-c]pyrimidine-7-carboxylic acid;hydrochloride
InChI:
InChI=1S/C7H7N3O3.ClH/c11-6(12)5-1-4-2-8-3-10(4)7(13)9-5;/h2-3,5H,1H2,(H,9,13)(H,11,12);1H/t5-;/m0./s1
InChI Key:
SZCNDUDBMDLVMR-JEDNCBNOSA-N
SMILES:
OC(=O)[C@@H]1Cc2cncn2C(=O)N1.Cl
Properties
Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
217.025g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
217.609g/mol
Monoisotopic Mass:
217.025g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties