N-[4-(3-methoxyphenoxy)phenyl]benzenesulfonamide

C19H17NO4S — CID 134156383

IUPACN-[4-(3-methoxyphenoxy)phenyl]benzenesulfonamide
SMILESCOc1cccc(Oc2ccc(NS(=O)(=O)c3ccccc3)cc2)c1
InChIInChI=1S/C19H17NO4S/c1-23-17-6-5-7-18(14-17)24-16-12-10-15(11-13-16)20-25(21,22)19-8-3-2-4-9-19/h2-14,20H,1H3
InChIKeyZYPIVMGGEGFNDR-UHFFFAOYSA-N
MW355.42 g/mol
LogP4.29
Rot. Bonds6

About N-[4-(3-methoxyphenoxy)phenyl]benzenesulfonamide

N-[4-(3-methoxyphenoxy)phenyl]benzenesulfonamide (PubChem CID 134156383) has the molecular formula C19H17NO4S and a molecular weight of 355.42 g/mol. Its IUPAC name is N-[4-(3-methoxyphenoxy)phenyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[4-(3-methoxyphenoxy)phenyl]benzenesulfonamide
PubChem CID134156383
Molecular FormulaC19H17NO4S
Molecular Weight355.42 g/mol
Exact Mass355.09
IUPAC NameN-[4-(3-methoxyphenoxy)phenyl]benzenesulfonamide
SMILESCOc1cccc(Oc2ccc(NS(=O)(=O)c3ccccc3)cc2)c1
InChIInChI=1S/C19H17NO4S/c1-23-17-6-5-7-18(14-17)24-16-12-10-15(11-13-16)20-25(21,22)19-8-3-2-4-9-19/h2-14,20H,1H3
InChIKeyZYPIVMGGEGFNDR-UHFFFAOYSA-N
XLogP4.29
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.42
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(3-methoxyphenoxy)phenyl]benzenesulfonamide?
The IUPAC name of N-[4-(3-methoxyphenoxy)phenyl]benzenesulfonamide (CID 134156383) is N-[4-(3-methoxyphenoxy)phenyl]benzenesulfonamide.
What is the SMILES notation for N-[4-(3-methoxyphenoxy)phenyl]benzenesulfonamide?
The canonical SMILES for N-[4-(3-methoxyphenoxy)phenyl]benzenesulfonamide is COc1cccc(Oc2ccc(NS(=O)(=O)c3ccccc3)cc2)c1.
What is the InChIKey of N-[4-(3-methoxyphenoxy)phenyl]benzenesulfonamide?
The InChIKey is ZYPIVMGGEGFNDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO4S/c1-23-17-6-5-7-18(14-17)24-16-12-10-15(11-13-16)20-25(21,22)19-8-3-2-4-9-19/h2-14,20H,1H3.
What are the key properties of N-[4-(3-methoxyphenoxy)phenyl]benzenesulfonamide?
N-[4-(3-methoxyphenoxy)phenyl]benzenesulfonamide has a molecular weight of 355.42 g/mol, XLogP of 4.29, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-methoxyphenoxy)phenyl]benzenesulfonamide is sourced from PubChem (CID 134156383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).