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89125-21-3 | 5-Pyrimidinesulfonamide,4,6-diamino-
CAS No: 89125-21-3 Catalog No: AG003YB1 MDL No:
Product Description
Catalog Number:
AG003YB1
Chemical Name:
5-Pyrimidinesulfonamide,4,6-diamino-
CAS Number:
89125-21-3
Molecular Formula:
C4H7N5O2S
Molecular Weight:
189.1957
IUPAC Name:
4,6-diaminopyrimidine-5-sulfonamide
InChI:
InChI=1S/C4H7N5O2S/c5-3-2(12(7,10)11)4(6)9-1-8-3/h1H,(H2,7,10,11)(H4,5,6,8,9)
InChI Key:
DLXKHVODJYERNM-UHFFFAOYSA-N
SMILES:
Nc1ncnc(c1S(=O)(=O)N)N
NSC Number:
65395
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.032g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
189.193g/mol
Monoisotopic Mass:
189.032g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
146A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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