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1538197-37-3 | 1-hexyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamide
CAS No: 1538197-37-3 Catalog No: AG01BTMR MDL No:MFCD24088085
Product Description
Catalog Number:
AG01BTMR
Chemical Name:
1-hexyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamide
CAS Number:
1538197-37-3
Molecular Formula:
C10H17N3O4S
Molecular Weight:
275.3247
MDL Number:
MFCD24088085
IUPAC Name:
1-hexyl-2,4-dioxopyrimidine-5-sulfonamide
InChI:
InChI=1S/C10H17N3O4S/c1-2-3-4-5-6-13-7-8(18(11,16)17)9(14)12-10(13)15/h7H,2-6H2,1H3,(H2,11,16,17)(H,12,14,15)
InChI Key:
OZSGIKLNMBJNCP-UHFFFAOYSA-N
SMILES:
CCCCCCn1cc(c(=O)[nH]c1=O)S(=O)(=O)N
Properties
Complexity:
464
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.094g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
275.323g/mol
Monoisotopic Mass:
275.094g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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