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379253-58-4 | N,1-dibutyl-2-sulfanyl-1H-1,3-benzodiazole-5-sulfonamide
CAS No: 379253-58-4 Catalog No: AG019HAZ MDL No:MFCD03041989
Product Description
Catalog Number:
AG019HAZ
Chemical Name:
N,1-dibutyl-2-sulfanyl-1H-1,3-benzodiazole-5-sulfonamide
CAS Number:
379253-58-4
Molecular Formula:
C15H23N3O2S2
Molecular Weight:
341.4920
MDL Number:
MFCD03041989
IUPAC Name:
N,1-dibutyl-2-sulfanylidene-3H-benzimidazole-5-sulfonamide
InChI:
InChI=1S/C15H23N3O2S2/c1-3-5-9-16-22(19,20)12-7-8-14-13(11-12)17-15(21)18(14)10-6-4-2/h7-8,11,16H,3-6,9-10H2,1-2H3,(H,17,21)
InChI Key:
ISGSJAPROVVUKZ-UHFFFAOYSA-N
SMILES:
CCCCNS(=O)(=O)c1ccc2c(c1)nc(n2CCCC)S
Properties
Complexity:
476
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.123g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
341.488g/mol
Monoisotopic Mass:
341.123g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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