N-(4-phenylmethoxyphenyl)thiophene-2-sulfonamide

C17H15NO3S2 — CID 741639

IUPACN-(4-phenylmethoxyphenyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(OCc2ccccc2)cc1)c1cccs1
InChIInChI=1S/C17H15NO3S2/c19-23(20,17-7-4-12-22-17)18-15-8-10-16(11-9-15)21-13-14-5-2-1-3-6-14/h1-12,18H,13H2
InChIKeyWNZWNAZUNNYFNS-UHFFFAOYSA-N
MW345.44 g/mol
LogP4.13
Rot. Bonds6

About N-(4-phenylmethoxyphenyl)thiophene-2-sulfonamide

N-(4-phenylmethoxyphenyl)thiophene-2-sulfonamide (PubChem CID 741639) has the molecular formula C17H15NO3S2 and a molecular weight of 345.44 g/mol. Its IUPAC name is N-(4-phenylmethoxyphenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(4-phenylmethoxyphenyl)thiophene-2-sulfonamide
PubChem CID741639
Molecular FormulaC17H15NO3S2
Molecular Weight345.44 g/mol
Exact Mass345.05
IUPAC NameN-(4-phenylmethoxyphenyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(OCc2ccccc2)cc1)c1cccs1
InChIInChI=1S/C17H15NO3S2/c19-23(20,17-7-4-12-22-17)18-15-8-10-16(11-9-15)21-13-14-5-2-1-3-6-14/h1-12,18H,13H2
InChIKeyWNZWNAZUNNYFNS-UHFFFAOYSA-N
XLogP4.13
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-phenylmethoxyphenyl)thiophene-2-sulfonamide?
The IUPAC name of N-(4-phenylmethoxyphenyl)thiophene-2-sulfonamide (CID 741639) is N-(4-phenylmethoxyphenyl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(4-phenylmethoxyphenyl)thiophene-2-sulfonamide?
The canonical SMILES for N-(4-phenylmethoxyphenyl)thiophene-2-sulfonamide is O=S(=O)(Nc1ccc(OCc2ccccc2)cc1)c1cccs1.
What is the InChIKey of N-(4-phenylmethoxyphenyl)thiophene-2-sulfonamide?
The InChIKey is WNZWNAZUNNYFNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO3S2/c19-23(20,17-7-4-12-22-17)18-15-8-10-16(11-9-15)21-13-14-5-2-1-3-6-14/h1-12,18H,13H2.
What are the key properties of N-(4-phenylmethoxyphenyl)thiophene-2-sulfonamide?
N-(4-phenylmethoxyphenyl)thiophene-2-sulfonamide has a molecular weight of 345.44 g/mol, XLogP of 4.13, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenylmethoxyphenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 741639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).