N-(2-chlorophenyl)-2-phenyl-3H-benzimidazole-5-sulfonamide

C19H14ClN3O2S — CID 6621527

IUPACN-(2-chlorophenyl)-2-phenyl-3H-benzimidazole-5-sulfonamide
SMILESO=S(=O)(Nc1ccccc1Cl)c1ccc2nc(-c3ccccc3)[nH]c2c1
InChIInChI=1S/C19H14ClN3O2S/c20-15-8-4-5-9-16(15)23-26(24,25)14-10-11-17-18(12-14)22-19(21-17)13-6-2-1-3-7-13/h1-12,23H,(H,21,22)
InChIKeyCTSXCZKWAXKZMP-UHFFFAOYSA-N
MW383.86 g/mol
LogP4.68
Rot. Bonds4

About N-(2-chlorophenyl)-2-phenyl-3H-benzimidazole-5-sulfonamide

N-(2-chlorophenyl)-2-phenyl-3H-benzimidazole-5-sulfonamide (PubChem CID 6621527) has the molecular formula C19H14ClN3O2S and a molecular weight of 383.86 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-phenyl-3H-benzimidazole-5-sulfonamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-phenyl-3H-benzimidazole-5-sulfonamide
PubChem CID6621527
Molecular FormulaC19H14ClN3O2S
Molecular Weight383.86 g/mol
Exact Mass383.05
IUPAC NameN-(2-chlorophenyl)-2-phenyl-3H-benzimidazole-5-sulfonamide
SMILESO=S(=O)(Nc1ccccc1Cl)c1ccc2nc(-c3ccccc3)[nH]c2c1
InChIInChI=1S/C19H14ClN3O2S/c20-15-8-4-5-9-16(15)23-26(24,25)14-10-11-17-18(12-14)22-19(21-17)13-6-2-1-3-7-13/h1-12,23H,(H,21,22)
InChIKeyCTSXCZKWAXKZMP-UHFFFAOYSA-N
XLogP4.68
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.86
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-phenyl-3H-benzimidazole-5-sulfonamide?
The IUPAC name of N-(2-chlorophenyl)-2-phenyl-3H-benzimidazole-5-sulfonamide (CID 6621527) is N-(2-chlorophenyl)-2-phenyl-3H-benzimidazole-5-sulfonamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-phenyl-3H-benzimidazole-5-sulfonamide?
The canonical SMILES for N-(2-chlorophenyl)-2-phenyl-3H-benzimidazole-5-sulfonamide is O=S(=O)(Nc1ccccc1Cl)c1ccc2nc(-c3ccccc3)[nH]c2c1.
What is the InChIKey of N-(2-chlorophenyl)-2-phenyl-3H-benzimidazole-5-sulfonamide?
The InChIKey is CTSXCZKWAXKZMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClN3O2S/c20-15-8-4-5-9-16(15)23-26(24,25)14-10-11-17-18(12-14)22-19(21-17)13-6-2-1-3-7-13/h1-12,23H,(H,21,22).
What are the key properties of N-(2-chlorophenyl)-2-phenyl-3H-benzimidazole-5-sulfonamide?
N-(2-chlorophenyl)-2-phenyl-3H-benzimidazole-5-sulfonamide has a molecular weight of 383.86 g/mol, XLogP of 4.68, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-phenyl-3H-benzimidazole-5-sulfonamide is sourced from PubChem (CID 6621527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).