SULFACLORAZOLE

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Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 13HX5F227D

Structure

InChI Key TZSHGYFVCVETTH-UHFFFAOYSA-N
Smiles Cc1cc(N[S](=O)(=O)c2ccc(N)cc2)n(n1)c3cccc(Cl)c3
InChI
InChI=1S/C16H15ClN4O2S/c1-11-9-16(21(19-11)14-4-2-3-12(17)10-14)20-24(22,23)15-7-5-13(18)6-8-15/h2-10,20H,18H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C16H15Cl1N4O2S1
Molecular Weight 362.06
AlogP 3.22
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 90.01
Heavy Atoms 24.0

Cross References

Resources Reference
CAS NUMBER 54063-55-7
NORMAN SUSDAT
FDA SRS 13HX5F227D
CONTENTS