4-hydroxy-N,N-bis(4-hydroxyphenyl)benzenesulfonamide

C18H15NO5S — CID 44580344

IUPAC4-hydroxy-N,N-bis(4-hydroxyphenyl)benzenesulfonamide
SMILESO=S(=O)(c1ccc(O)cc1)N(c1ccc(O)cc1)c1ccc(O)cc1
InChIInChI=1S/C18H15NO5S/c20-15-5-1-13(2-6-15)19(14-3-7-16(21)8-4-14)25(23,24)18-11-9-17(22)10-12-18/h1-12,20-22H
InChIKeyKRCHHIZZHGISRT-UHFFFAOYSA-N
MW357.39 g/mol
LogP3.33
Rot. Bonds4

About 4-hydroxy-N,N-bis(4-hydroxyphenyl)benzenesulfonamide

4-hydroxy-N,N-bis(4-hydroxyphenyl)benzenesulfonamide (PubChem CID 44580344) has the molecular formula C18H15NO5S and a molecular weight of 357.39 g/mol. Its IUPAC name is 4-hydroxy-N,N-bis(4-hydroxyphenyl)benzenesulfonamide.

Molecular Properties

Compound Name4-hydroxy-N,N-bis(4-hydroxyphenyl)benzenesulfonamide
PubChem CID44580344
Molecular FormulaC18H15NO5S
Molecular Weight357.39 g/mol
Exact Mass357.07
IUPAC Name4-hydroxy-N,N-bis(4-hydroxyphenyl)benzenesulfonamide
SMILESO=S(=O)(c1ccc(O)cc1)N(c1ccc(O)cc1)c1ccc(O)cc1
InChIInChI=1S/C18H15NO5S/c20-15-5-1-13(2-6-15)19(14-3-7-16(21)8-4-14)25(23,24)18-11-9-17(22)10-12-18/h1-12,20-22H
InChIKeyKRCHHIZZHGISRT-UHFFFAOYSA-N
XLogP3.33
TPSA98.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.39
LogP ≤ 53.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N,N-bis(4-hydroxyphenyl)benzenesulfonamide?
The IUPAC name of 4-hydroxy-N,N-bis(4-hydroxyphenyl)benzenesulfonamide (CID 44580344) is 4-hydroxy-N,N-bis(4-hydroxyphenyl)benzenesulfonamide.
What is the SMILES notation for 4-hydroxy-N,N-bis(4-hydroxyphenyl)benzenesulfonamide?
The canonical SMILES for 4-hydroxy-N,N-bis(4-hydroxyphenyl)benzenesulfonamide is O=S(=O)(c1ccc(O)cc1)N(c1ccc(O)cc1)c1ccc(O)cc1.
What is the InChIKey of 4-hydroxy-N,N-bis(4-hydroxyphenyl)benzenesulfonamide?
The InChIKey is KRCHHIZZHGISRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO5S/c20-15-5-1-13(2-6-15)19(14-3-7-16(21)8-4-14)25(23,24)18-11-9-17(22)10-12-18/h1-12,20-22H.
What are the key properties of 4-hydroxy-N,N-bis(4-hydroxyphenyl)benzenesulfonamide?
4-hydroxy-N,N-bis(4-hydroxyphenyl)benzenesulfonamide has a molecular weight of 357.39 g/mol, XLogP of 3.33, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N,N-bis(4-hydroxyphenyl)benzenesulfonamide is sourced from PubChem (CID 44580344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).