2-(benzenesulfonamido)-N-[3-(1H-benzimidazol-2-yl)phenyl]benzamide

C26H20N4O3S — CID 121040702

IUPAC2-(benzenesulfonamido)-N-[3-(1H-benzimidazol-2-yl)phenyl]benzamide
SMILESO=C(Nc1cccc(-c2nc3ccccc3[nH]2)c1)c1ccccc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C26H20N4O3S/c31-26(21-13-4-5-14-22(21)30-34(32,33)20-11-2-1-3-12-20)27-19-10-8-9-18(17-19)25-28-23-15-6-7-16-24(23)29-25/h1-17,30H,(H,27,31)(H,28,29)
InChIKeyZEEZGQRAETXHTB-UHFFFAOYSA-N
MW468.54 g/mol
LogP5.28
Rot. Bonds6

About 2-(benzenesulfonamido)-N-[3-(1H-benzimidazol-2-yl)phenyl]benzamide

2-(benzenesulfonamido)-N-[3-(1H-benzimidazol-2-yl)phenyl]benzamide (PubChem CID 121040702) has the molecular formula C26H20N4O3S and a molecular weight of 468.54 g/mol. Its IUPAC name is 2-(benzenesulfonamido)-N-[3-(1H-benzimidazol-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name2-(benzenesulfonamido)-N-[3-(1H-benzimidazol-2-yl)phenyl]benzamide
PubChem CID121040702
Molecular FormulaC26H20N4O3S
Molecular Weight468.54 g/mol
Exact Mass468.13
IUPAC Name2-(benzenesulfonamido)-N-[3-(1H-benzimidazol-2-yl)phenyl]benzamide
SMILESO=C(Nc1cccc(-c2nc3ccccc3[nH]2)c1)c1ccccc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C26H20N4O3S/c31-26(21-13-4-5-14-22(21)30-34(32,33)20-11-2-1-3-12-20)27-19-10-8-9-18(17-19)25-28-23-15-6-7-16-24(23)29-25/h1-17,30H,(H,27,31)(H,28,29)
InChIKeyZEEZGQRAETXHTB-UHFFFAOYSA-N
XLogP5.28
TPSA103.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.54
LogP ≤ 55.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(1H-benzimidazol-2-yl)phenyl]-2-chloro-5-methylsulfonylbenzamide
CID 78792274
N-[3-(1H-benzimidazol-2-yl)phenyl]-3-ethylsulfonylbenzamide
CID 7522685
N-[3-(1H-benzimidazol-2-yl)phenyl]-2-chloro-5-piperidin-1-ylsulfonylbenzamide
CID 39911760
N-[3-(1H-benzimidazol-2-yl)phenyl]-4-bromobenzenesulfonamide
CID 100580950
N-[4-(1H-benzimidazol-2-yl)phenyl]-3-[(4-methylphenyl)sulfonylamino]pyridine-4-carboxamide
CID 70789530
N-[3-(1H-benzimidazol-2-yl)phenyl]-2,4,5-trimethoxybenzamide
CID 51109807
N-[3-(1H-benzimidazol-2-yl)phenyl]-2,6-difluorobenzamide
CID 3706187
N-[3-(1H-benzimidazol-2-yl)phenyl]-3,5-dimethylbenzamide
CID 969400
N-[3-(1H-benzimidazol-2-yl)phenyl]-3-(trifluoromethyl)benzamide
CID 4124334
N-[3-(1H-benzimidazol-2-yl)phenyl]-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 44993117
3-acetamido-N-[3-[3-(1H-benzimidazol-2-yl)phenyl]phenyl]benzamide
CID 44523579
N-[3-(1H-benzimidazol-2-yl)phenyl]-4-methoxybenzamide
CID 2810335

Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonamido)-N-[3-(1H-benzimidazol-2-yl)phenyl]benzamide?
The IUPAC name of 2-(benzenesulfonamido)-N-[3-(1H-benzimidazol-2-yl)phenyl]benzamide (CID 121040702) is 2-(benzenesulfonamido)-N-[3-(1H-benzimidazol-2-yl)phenyl]benzamide.
What is the SMILES notation for 2-(benzenesulfonamido)-N-[3-(1H-benzimidazol-2-yl)phenyl]benzamide?
The canonical SMILES for 2-(benzenesulfonamido)-N-[3-(1H-benzimidazol-2-yl)phenyl]benzamide is O=C(Nc1cccc(-c2nc3ccccc3[nH]2)c1)c1ccccc1NS(=O)(=O)c1ccccc1.
What is the InChIKey of 2-(benzenesulfonamido)-N-[3-(1H-benzimidazol-2-yl)phenyl]benzamide?
The InChIKey is ZEEZGQRAETXHTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20N4O3S/c31-26(21-13-4-5-14-22(21)30-34(32,33)20-11-2-1-3-12-20)27-19-10-8-9-18(17-19)25-28-23-15-6-7-16-24(23)29-25/h1-17,30H,(H,27,31)(H,28,29).
What are the key properties of 2-(benzenesulfonamido)-N-[3-(1H-benzimidazol-2-yl)phenyl]benzamide?
2-(benzenesulfonamido)-N-[3-(1H-benzimidazol-2-yl)phenyl]benzamide has a molecular weight of 468.54 g/mol, XLogP of 5.28, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonamido)-N-[3-(1H-benzimidazol-2-yl)phenyl]benzamide is sourced from PubChem (CID 121040702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).