N-(1H-indol-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide

C17H16N4O3S — CID 53373006

IUPACN-(1H-indol-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
SMILESO=C1NCCN1c1ccc(S(=O)(=O)Nc2ccc3[nH]ccc3c2)cc1
InChIInChI=1S/C17H16N4O3S/c22-17-19-9-10-21(17)14-2-4-15(5-3-14)25(23,24)20-13-1-6-16-12(11-13)7-8-18-16/h1-8,11,18,20H,9-10H2,(H,19,22)
InChIKeyBKDOGPZPQIXCIG-UHFFFAOYSA-N
MW356.41 g/mol
LogP2.50
Rot. Bonds4

About N-(1H-indol-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide

N-(1H-indol-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide (PubChem CID 53373006) has the molecular formula C17H16N4O3S and a molecular weight of 356.41 g/mol. Its IUPAC name is N-(1H-indol-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(1H-indol-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
PubChem CID53373006
Molecular FormulaC17H16N4O3S
Molecular Weight356.41 g/mol
Exact Mass356.09
IUPAC NameN-(1H-indol-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide
SMILESO=C1NCCN1c1ccc(S(=O)(=O)Nc2ccc3[nH]ccc3c2)cc1
InChIInChI=1S/C17H16N4O3S/c22-17-19-9-10-21(17)14-2-4-15(5-3-14)25(23,24)20-13-1-6-16-12(11-13)7-8-18-16/h1-8,11,18,20H,9-10H2,(H,19,22)
InChIKeyBKDOGPZPQIXCIG-UHFFFAOYSA-N
XLogP2.50
TPSA94.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.41
LogP ≤ 52.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide?
The IUPAC name of N-(1H-indol-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide (CID 53373006) is N-(1H-indol-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide.
What is the SMILES notation for N-(1H-indol-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide?
The canonical SMILES for N-(1H-indol-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide is O=C1NCCN1c1ccc(S(=O)(=O)Nc2ccc3[nH]ccc3c2)cc1.
What is the InChIKey of N-(1H-indol-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide?
The InChIKey is BKDOGPZPQIXCIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O3S/c22-17-19-9-10-21(17)14-2-4-15(5-3-14)25(23,24)20-13-1-6-16-12(11-13)7-8-18-16/h1-8,11,18,20H,9-10H2,(H,19,22).
What are the key properties of N-(1H-indol-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide?
N-(1H-indol-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide has a molecular weight of 356.41 g/mol, XLogP of 2.50, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-5-yl)-4-(2-oxoimidazolidin-1-yl)benzenesulfonamide is sourced from PubChem (CID 53373006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).