N-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide

C17H16N4O3S — CID 17473290

IUPACN-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide
SMILESO=C(Nn1cnc2ccccc21)c1cccc(S(=O)(=O)NC2CC2)c1
InChIInChI=1S/C17H16N4O3S/c22-17(19-21-11-18-15-6-1-2-7-16(15)21)12-4-3-5-14(10-12)25(23,24)20-13-8-9-13/h1-7,10-11,13,20H,8-9H2,(H,19,22)
InChIKeyOQCXWELSACLYSS-UHFFFAOYSA-N
MW356.41 g/mol
LogP1.86
Rot. Bonds5

About N-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide

N-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide (PubChem CID 17473290) has the molecular formula C17H16N4O3S and a molecular weight of 356.41 g/mol. Its IUPAC name is N-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide
PubChem CID17473290
Molecular FormulaC17H16N4O3S
Molecular Weight356.41 g/mol
Exact Mass356.09
IUPAC NameN-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide
SMILESO=C(Nn1cnc2ccccc21)c1cccc(S(=O)(=O)NC2CC2)c1
InChIInChI=1S/C17H16N4O3S/c22-17(19-21-11-18-15-6-1-2-7-16(15)21)12-4-3-5-14(10-12)25(23,24)20-13-8-9-13/h1-7,10-11,13,20H,8-9H2,(H,19,22)
InChIKeyOQCXWELSACLYSS-UHFFFAOYSA-N
XLogP1.86
TPSA93.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.41
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-acetylpiperazin-1-yl)sulfonyl-N-(benzimidazol-1-yl)benzamide
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3-(cyclopropylsulfamoyl)-N-pyridin-4-ylbenzamide
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N-cyclopropyl-3-[[(2-hydroxybenzoyl)amino]carbamoyl]benzenesulfonamide
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N-(benzimidazol-1-yl)-3-imidazol-1-ylbenzamide
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3-(cyclopropylsulfamoyl)-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119450174
N-(1H-benzimidazol-2-ylmethyl)-3-(cyclopropylsulfamoyl)benzamide
CID 18105121
3-(cyclopentylsulfamoyl)-N-ethylbenzamide
CID 30830540
3-(cyclopentylsulfamoyl)-N-(2-hydroxyethyl)benzamide
CID 78854342
3-(cyclopentylsulfamoyl)-N-piperidin-3-ylbenzamide
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N-(5-chloro-2-fluorophenyl)-3-(cyclopropylsulfamoyl)benzamide
CID 94006212
3-(cyclopentylsulfamoyl)-N-(2-fluorophenyl)benzamide
CID 109063181

Frequently Asked Questions

What is the IUPAC name of N-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide?
The IUPAC name of N-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide (CID 17473290) is N-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide.
What is the SMILES notation for N-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide?
The canonical SMILES for N-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide is O=C(Nn1cnc2ccccc21)c1cccc(S(=O)(=O)NC2CC2)c1.
What is the InChIKey of N-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide?
The InChIKey is OQCXWELSACLYSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O3S/c22-17(19-21-11-18-15-6-1-2-7-16(15)21)12-4-3-5-14(10-12)25(23,24)20-13-8-9-13/h1-7,10-11,13,20H,8-9H2,(H,19,22).
What are the key properties of N-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide?
N-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide has a molecular weight of 356.41 g/mol, XLogP of 1.86, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzimidazol-1-yl)-3-(cyclopropylsulfamoyl)benzamide is sourced from PubChem (CID 17473290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).