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1508042-91-8 | 2,4-dioxo-1-propyl-1,2,3,4-tetrahydropyrimidine-5-sulfonamide
CAS No: 1508042-91-8 Catalog No: AG01B3DV MDL No:MFCD24088098
Product Description
Catalog Number:
AG01B3DV
Chemical Name:
2,4-dioxo-1-propyl-1,2,3,4-tetrahydropyrimidine-5-sulfonamide
CAS Number:
1508042-91-8
Molecular Formula:
C7H11N3O4S
Molecular Weight:
233.2449
MDL Number:
MFCD24088098
IUPAC Name:
2,4-dioxo-1-propylpyrimidine-5-sulfonamide
InChI:
InChI=1S/C7H11N3O4S/c1-2-3-10-4-5(15(8,13)14)6(11)9-7(10)12/h4H,2-3H2,1H3,(H2,8,13,14)(H,9,11,12)
InChI Key:
WXLASUVBXXNOGT-UHFFFAOYSA-N
SMILES:
CCCn1cc(c(=O)[nH]c1=O)S(=O)(=O)N
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.047g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
233.242g/mol
Monoisotopic Mass:
233.047g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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