3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide

C16H11Cl2NO3S — CID 58496706

IUPAC3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1cccc2c(O)cccc12)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C16H11Cl2NO3S/c17-10-7-11(18)9-12(8-10)23(21,22)19-15-5-1-4-14-13(15)3-2-6-16(14)20/h1-9,19-20H
InChIKeyMHBNJMSAHSUTPY-UHFFFAOYSA-N
MW368.24 g/mol
LogP4.65
Rot. Bonds3

About 3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide

3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide (PubChem CID 58496706) has the molecular formula C16H11Cl2NO3S and a molecular weight of 368.24 g/mol. Its IUPAC name is 3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide.

Molecular Properties

Compound Name3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide
PubChem CID58496706
Molecular FormulaC16H11Cl2NO3S
Molecular Weight368.24 g/mol
Exact Mass366.98
IUPAC Name3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1cccc2c(O)cccc12)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C16H11Cl2NO3S/c17-10-7-11(18)9-12(8-10)23(21,22)19-15-5-1-4-14-13(15)3-2-6-16(14)20/h1-9,19-20H
InChIKeyMHBNJMSAHSUTPY-UHFFFAOYSA-N
XLogP4.65
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.24
LogP ≤ 54.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dichloro-N-(2-hydroxyphenyl)benzenesulfonamide
CID 4993615
3,5-dichloro-N-(5-propanoylnaphthalen-1-yl)benzenesulfonamide
CID 58496889
5-[(3,5-dichlorophenyl)sulfonylamino]-N,N-dimethylnaphthalene-1-sulfonamide;methane
CID 159593175
3-chloro-5-fluoro-N-naphthalen-1-ylbenzenesulfonamide
CID 59533991
3,5-dichloro-N-(2-sulfamoylphenyl)benzenesulfonamide
CID 47060111
N-[5-(benzenesulfonamido)naphthalen-1-yl]benzenesulfonamide
CID 3389796
5-[(3,5-dichlorophenyl)sulfonylamino]-N-[(3-methoxyphenyl)methyl]naphthalene-1-carboxamide
CID 66908825
4-[(3,5-dichlorophenyl)sulfonylamino]-2-hydroxybenzoic acid
CID 45330209
N-(5-bromo-2-hydroxyphenyl)-3-chlorobenzenesulfonamide
CID 79822200
N-[5-(naphthalen-2-ylsulfonylamino)naphthalen-1-yl]naphthalene-2-sulfonamide
CID 3407912
3-chloro-4-fluoro-N-naphthalen-1-ylbenzenesulfonamide
CID 3464007
3-chloro-N-(4-chloro-3-hydroxyphenyl)benzenesulfonamide
CID 64788491

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide?
The IUPAC name of 3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide (CID 58496706) is 3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide.
What is the SMILES notation for 3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide?
The canonical SMILES for 3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide is O=S(=O)(Nc1cccc2c(O)cccc12)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide?
The InChIKey is MHBNJMSAHSUTPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11Cl2NO3S/c17-10-7-11(18)9-12(8-10)23(21,22)19-15-5-1-4-14-13(15)3-2-6-16(14)20/h1-9,19-20H.
What are the key properties of 3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide?
3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide has a molecular weight of 368.24 g/mol, XLogP of 4.65, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-(5-hydroxynaphthalen-1-yl)benzenesulfonamide is sourced from PubChem (CID 58496706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).