N-[3-(4-hydroxyphenyl)-4-methoxyphenyl]-4-methoxybenzenesulfonamide

C20H19NO5S — CID 155568905

IUPACN-[3-(4-hydroxyphenyl)-4-methoxyphenyl]-4-methoxybenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc(OC)c(-c3ccc(O)cc3)c2)cc1
InChIInChI=1S/C20H19NO5S/c1-25-17-8-10-18(11-9-17)27(23,24)21-15-5-12-20(26-2)19(13-15)14-3-6-16(22)7-4-14/h3-13,21-22H,1-2H3
InChIKeyFRDNBOMPGFXCGH-UHFFFAOYSA-N
MW385.44 g/mol
LogP3.88
Rot. Bonds6

About N-[3-(4-hydroxyphenyl)-4-methoxyphenyl]-4-methoxybenzenesulfonamide

N-[3-(4-hydroxyphenyl)-4-methoxyphenyl]-4-methoxybenzenesulfonamide (PubChem CID 155568905) has the molecular formula C20H19NO5S and a molecular weight of 385.44 g/mol. Its IUPAC name is N-[3-(4-hydroxyphenyl)-4-methoxyphenyl]-4-methoxybenzenesulfonamide.

Molecular Properties

Compound NameN-[3-(4-hydroxyphenyl)-4-methoxyphenyl]-4-methoxybenzenesulfonamide
PubChem CID155568905
Molecular FormulaC20H19NO5S
Molecular Weight385.44 g/mol
Exact Mass385.10
IUPAC NameN-[3-(4-hydroxyphenyl)-4-methoxyphenyl]-4-methoxybenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc(OC)c(-c3ccc(O)cc3)c2)cc1
InChIInChI=1S/C20H19NO5S/c1-25-17-8-10-18(11-9-17)27(23,24)21-15-5-12-20(26-2)19(13-15)14-3-6-16(22)7-4-14/h3-13,21-22H,1-2H3
InChIKeyFRDNBOMPGFXCGH-UHFFFAOYSA-N
XLogP3.88
TPSA84.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.44
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[3-(4-hydroxyphenyl)-4-methoxyphenyl]-4-methoxybenzenesulfonamide?
The IUPAC name of N-[3-(4-hydroxyphenyl)-4-methoxyphenyl]-4-methoxybenzenesulfonamide (CID 155568905) is N-[3-(4-hydroxyphenyl)-4-methoxyphenyl]-4-methoxybenzenesulfonamide.
What is the SMILES notation for N-[3-(4-hydroxyphenyl)-4-methoxyphenyl]-4-methoxybenzenesulfonamide?
The canonical SMILES for N-[3-(4-hydroxyphenyl)-4-methoxyphenyl]-4-methoxybenzenesulfonamide is COc1ccc(S(=O)(=O)Nc2ccc(OC)c(-c3ccc(O)cc3)c2)cc1.
What is the InChIKey of N-[3-(4-hydroxyphenyl)-4-methoxyphenyl]-4-methoxybenzenesulfonamide?
The InChIKey is FRDNBOMPGFXCGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO5S/c1-25-17-8-10-18(11-9-17)27(23,24)21-15-5-12-20(26-2)19(13-15)14-3-6-16(22)7-4-14/h3-13,21-22H,1-2H3.
What are the key properties of N-[3-(4-hydroxyphenyl)-4-methoxyphenyl]-4-methoxybenzenesulfonamide?
N-[3-(4-hydroxyphenyl)-4-methoxyphenyl]-4-methoxybenzenesulfonamide has a molecular weight of 385.44 g/mol, XLogP of 3.88, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-hydroxyphenyl)-4-methoxyphenyl]-4-methoxybenzenesulfonamide is sourced from PubChem (CID 155568905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).