N-(3H-benzimidazol-5-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide

C15H12N4O3S — CID 110724406

IUPACN-(3H-benzimidazol-5-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide
SMILESO=C1Cc2cc(S(=O)(=O)Nc3ccc4nc[nH]c4c3)ccc2N1
InChIInChI=1S/C15H12N4O3S/c20-15-6-9-5-11(2-4-12(9)18-15)23(21,22)19-10-1-3-13-14(7-10)17-8-16-13/h1-5,7-8,19H,6H2,(H,16,17)(H,18,20)
InChIKeyWJKLQNTXJKFCLX-UHFFFAOYSA-N
MW328.35 g/mol
LogP1.86
Rot. Bonds3

About N-(3H-benzimidazol-5-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide

N-(3H-benzimidazol-5-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide (PubChem CID 110724406) has the molecular formula C15H12N4O3S and a molecular weight of 328.35 g/mol. Its IUPAC name is N-(3H-benzimidazol-5-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide.

Molecular Properties

Compound NameN-(3H-benzimidazol-5-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide
PubChem CID110724406
Molecular FormulaC15H12N4O3S
Molecular Weight328.35 g/mol
Exact Mass328.06
IUPAC NameN-(3H-benzimidazol-5-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide
SMILESO=C1Cc2cc(S(=O)(=O)Nc3ccc4nc[nH]c4c3)ccc2N1
InChIInChI=1S/C15H12N4O3S/c20-15-6-9-5-11(2-4-12(9)18-15)23(21,22)19-10-1-3-13-14(7-10)17-8-16-13/h1-5,7-8,19H,6H2,(H,16,17)(H,18,20)
InChIKeyWJKLQNTXJKFCLX-UHFFFAOYSA-N
XLogP1.86
TPSA103.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.35
LogP ≤ 51.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1H-indol-6-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 110730882
N-(1,3-benzoxazol-6-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 110728971
2-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1,3-dihydroindole-5-sulfonamide
CID 110724194
N-(3,4-dichlorophenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 9055840
N-(1H-indazol-6-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 7530705
N-[4-(cyclohexylamino)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 112980793
N-(2-oxo-1,3-dihydroindol-5-yl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 20933336
4-fluoro-N-(2-oxo-1,3-dihydroindol-5-yl)benzenesulfonamide
CID 18570748
N-(3-bromophenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 8015526
N-(3-methylphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 18197715
N-(3H-benzimidazol-5-yl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 110724383
N-(5-fluoro-3-pyridinyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 110872393

Frequently Asked Questions

What is the IUPAC name of N-(3H-benzimidazol-5-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide?
The IUPAC name of N-(3H-benzimidazol-5-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide (CID 110724406) is N-(3H-benzimidazol-5-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide.
What is the SMILES notation for N-(3H-benzimidazol-5-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide?
The canonical SMILES for N-(3H-benzimidazol-5-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide is O=C1Cc2cc(S(=O)(=O)Nc3ccc4nc[nH]c4c3)ccc2N1.
What is the InChIKey of N-(3H-benzimidazol-5-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide?
The InChIKey is WJKLQNTXJKFCLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O3S/c20-15-6-9-5-11(2-4-12(9)18-15)23(21,22)19-10-1-3-13-14(7-10)17-8-16-13/h1-5,7-8,19H,6H2,(H,16,17)(H,18,20).
What are the key properties of N-(3H-benzimidazol-5-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide?
N-(3H-benzimidazol-5-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide has a molecular weight of 328.35 g/mol, XLogP of 1.86, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3H-benzimidazol-5-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide is sourced from PubChem (CID 110724406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).