2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide

C19H15BrN2O3S — CID 2332035

IUPAC2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccccc1NS(=O)(=O)c1ccc(Br)cc1
InChIInChI=1S/C19H15BrN2O3S/c20-14-10-12-16(13-11-14)26(24,25)22-18-9-5-4-8-17(18)19(23)21-15-6-2-1-3-7-15/h1-13,22H,(H,21,23)
InChIKeySMTAAWSFWQIPFX-UHFFFAOYSA-N
MW431.31 g/mol
LogP4.50
Rot. Bonds5

About 2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide

2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide (PubChem CID 2332035) has the molecular formula C19H15BrN2O3S and a molecular weight of 431.31 g/mol. Its IUPAC name is 2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide.

Molecular Properties

Compound Name2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide
PubChem CID2332035
Molecular FormulaC19H15BrN2O3S
Molecular Weight431.31 g/mol
Exact Mass430.00
IUPAC Name2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccccc1NS(=O)(=O)c1ccc(Br)cc1
InChIInChI=1S/C19H15BrN2O3S/c20-14-10-12-16(13-11-14)26(24,25)22-18-9-5-4-8-17(18)19(23)21-15-6-2-1-3-7-15/h1-13,22H,(H,21,23)
InChIKeySMTAAWSFWQIPFX-UHFFFAOYSA-N
XLogP4.50
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.31
LogP ≤ 54.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-bromophenyl)-2-[(4-ethoxyphenyl)sulfonylamino]benzamide
CID 2332106
2-[(4-bromophenyl)sulfonylamino]-N-(2,3-dimethylphenyl)benzamide
CID 2334087
2-(benzenesulfonamido)-N-(4-chlorophenyl)benzamide
CID 1243115
2-(benzenesulfonamido)-N-(4-bromo-2-fluorophenyl)benzamide
CID 4223375
2-[(4-bromophenyl)sulfonylamino]-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 2336813
2-(benzenesulfonamido)-N-(4-phenoxyphenyl)benzamide
CID 3900171
2-[(4-bromophenyl)sulfonylamino]-N-(2-phenylethyl)benzamide
CID 2333846
4-bromo-2-fluoro-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 164615573
N-(3-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]benzamide
CID 2332033
N-(3-benzamidophenyl)-2-[(4-fluorophenyl)sulfonylamino]benzamide
CID 55869973
2-(benzenesulfonamido)-N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 126414109
2-[(4-bromophenyl)sulfonylamino]-N-[4-chloro-3-(dimethylsulfamoyl)phenyl]benzamide
CID 3435467

Frequently Asked Questions

What is the IUPAC name of 2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide?
The IUPAC name of 2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide (CID 2332035) is 2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide.
What is the SMILES notation for 2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide?
The canonical SMILES for 2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide is O=C(Nc1ccccc1)c1ccccc1NS(=O)(=O)c1ccc(Br)cc1.
What is the InChIKey of 2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide?
The InChIKey is SMTAAWSFWQIPFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15BrN2O3S/c20-14-10-12-16(13-11-14)26(24,25)22-18-9-5-4-8-17(18)19(23)21-15-6-2-1-3-7-15/h1-13,22H,(H,21,23).
What are the key properties of 2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide?
2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide has a molecular weight of 431.31 g/mol, XLogP of 4.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide is sourced from PubChem (CID 2332035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).