2-(2-bromophenyl)-N-(2-bromo-4-sulfamoylphenyl)acetamide

C14H12Br2N2O3S — CID 71764612

IUPAC2-(2-bromophenyl)-N-(2-bromo-4-sulfamoylphenyl)acetamide
SMILESNS(=O)(=O)c1ccc(NC(=O)Cc2ccccc2Br)c(Br)c1
InChIInChI=1S/C14H12Br2N2O3S/c15-11-4-2-1-3-9(11)7-14(19)18-13-6-5-10(8-12(13)16)22(17,20)21/h1-6,8H,7H2,(H,18,19)(H2,17,20,21)
InChIKeyIMNAZTLPVPEWJW-UHFFFAOYSA-N
MW448.14 g/mol
LogP3.04
Rot. Bonds4

About 2-(2-bromophenyl)-N-(2-bromo-4-sulfamoylphenyl)acetamide

2-(2-bromophenyl)-N-(2-bromo-4-sulfamoylphenyl)acetamide (PubChem CID 71764612) has the molecular formula C14H12Br2N2O3S and a molecular weight of 448.14 g/mol. Its IUPAC name is 2-(2-bromophenyl)-N-(2-bromo-4-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-bromophenyl)-N-(2-bromo-4-sulfamoylphenyl)acetamide
PubChem CID71764612
Molecular FormulaC14H12Br2N2O3S
Molecular Weight448.14 g/mol
Exact Mass445.89
IUPAC Name2-(2-bromophenyl)-N-(2-bromo-4-sulfamoylphenyl)acetamide
SMILESNS(=O)(=O)c1ccc(NC(=O)Cc2ccccc2Br)c(Br)c1
InChIInChI=1S/C14H12Br2N2O3S/c15-11-4-2-1-3-9(11)7-14(19)18-13-6-5-10(8-12(13)16)22(17,20)21/h1-6,8H,7H2,(H,18,19)(H2,17,20,21)
InChIKeyIMNAZTLPVPEWJW-UHFFFAOYSA-N
XLogP3.04
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500448.14
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-N-(2-bromo-4-sulfamoylphenyl)acetamide?
The IUPAC name of 2-(2-bromophenyl)-N-(2-bromo-4-sulfamoylphenyl)acetamide (CID 71764612) is 2-(2-bromophenyl)-N-(2-bromo-4-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-(2-bromophenyl)-N-(2-bromo-4-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-(2-bromophenyl)-N-(2-bromo-4-sulfamoylphenyl)acetamide is NS(=O)(=O)c1ccc(NC(=O)Cc2ccccc2Br)c(Br)c1.
What is the InChIKey of 2-(2-bromophenyl)-N-(2-bromo-4-sulfamoylphenyl)acetamide?
The InChIKey is IMNAZTLPVPEWJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Br2N2O3S/c15-11-4-2-1-3-9(11)7-14(19)18-13-6-5-10(8-12(13)16)22(17,20)21/h1-6,8H,7H2,(H,18,19)(H2,17,20,21).
What are the key properties of 2-(2-bromophenyl)-N-(2-bromo-4-sulfamoylphenyl)acetamide?
2-(2-bromophenyl)-N-(2-bromo-4-sulfamoylphenyl)acetamide has a molecular weight of 448.14 g/mol, XLogP of 3.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-N-(2-bromo-4-sulfamoylphenyl)acetamide is sourced from PubChem (CID 71764612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).