N-(2-bromophenyl)sulfonyl-2-(2-methoxyphenoxy)acetamide

C15H14BrNO5S — CID 75403998

IUPACN-(2-bromophenyl)sulfonyl-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)NS(=O)(=O)c1ccccc1Br
InChIInChI=1S/C15H14BrNO5S/c1-21-12-7-3-4-8-13(12)22-10-15(18)17-23(19,20)14-9-5-2-6-11(14)16/h2-9H,10H2,1H3,(H,17,18)
InChIKeyVJUIGVHLXFPVOM-UHFFFAOYSA-N
MW400.25 g/mol
LogP2.34
Rot. Bonds6

About N-(2-bromophenyl)sulfonyl-2-(2-methoxyphenoxy)acetamide

N-(2-bromophenyl)sulfonyl-2-(2-methoxyphenoxy)acetamide (PubChem CID 75403998) has the molecular formula C15H14BrNO5S and a molecular weight of 400.25 g/mol. Its IUPAC name is N-(2-bromophenyl)sulfonyl-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-bromophenyl)sulfonyl-2-(2-methoxyphenoxy)acetamide
PubChem CID75403998
Molecular FormulaC15H14BrNO5S
Molecular Weight400.25 g/mol
Exact Mass398.98
IUPAC NameN-(2-bromophenyl)sulfonyl-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)NS(=O)(=O)c1ccccc1Br
InChIInChI=1S/C15H14BrNO5S/c1-21-12-7-3-4-8-13(12)22-10-15(18)17-23(19,20)14-9-5-2-6-11(14)16/h2-9H,10H2,1H3,(H,17,18)
InChIKeyVJUIGVHLXFPVOM-UHFFFAOYSA-N
XLogP2.34
TPSA81.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.25
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)sulfonyl-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N-(2-bromophenyl)sulfonyl-2-(2-methoxyphenoxy)acetamide (CID 75403998) is N-(2-bromophenyl)sulfonyl-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N-(2-bromophenyl)sulfonyl-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N-(2-bromophenyl)sulfonyl-2-(2-methoxyphenoxy)acetamide is COc1ccccc1OCC(=O)NS(=O)(=O)c1ccccc1Br.
What is the InChIKey of N-(2-bromophenyl)sulfonyl-2-(2-methoxyphenoxy)acetamide?
The InChIKey is VJUIGVHLXFPVOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrNO5S/c1-21-12-7-3-4-8-13(12)22-10-15(18)17-23(19,20)14-9-5-2-6-11(14)16/h2-9H,10H2,1H3,(H,17,18).
What are the key properties of N-(2-bromophenyl)sulfonyl-2-(2-methoxyphenoxy)acetamide?
N-(2-bromophenyl)sulfonyl-2-(2-methoxyphenoxy)acetamide has a molecular weight of 400.25 g/mol, XLogP of 2.34, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)sulfonyl-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 75403998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).