1-[(1-benzoyl-2,3-dihydroindol-5-yl)sulfonyl]-4-phenylimidazolidin-2-one

C24H21N3O4S — CID 21224938

IUPAC1-[(1-benzoyl-2,3-dihydroindol-5-yl)sulfonyl]-4-phenylimidazolidin-2-one
SMILESO=C(c1ccccc1)N1CCc2cc(S(=O)(=O)N3CC(c4ccccc4)NC3=O)ccc21
InChIInChI=1S/C24H21N3O4S/c28-23(18-9-5-2-6-10-18)26-14-13-19-15-20(11-12-22(19)26)32(30,31)27-16-21(25-24(27)29)17-7-3-1-4-8-17/h1-12,15,21H,13-14,16H2,(H,25,29)
InChIKeyOXCLENVMHHTHLI-UHFFFAOYSA-N
MW447.52 g/mol
LogP3.34
Rot. Bonds4

About 1-[(1-benzoyl-2,3-dihydroindol-5-yl)sulfonyl]-4-phenylimidazolidin-2-one

1-[(1-benzoyl-2,3-dihydroindol-5-yl)sulfonyl]-4-phenylimidazolidin-2-one (PubChem CID 21224938) has the molecular formula C24H21N3O4S and a molecular weight of 447.52 g/mol. Its IUPAC name is 1-[(1-benzoyl-2,3-dihydroindol-5-yl)sulfonyl]-4-phenylimidazolidin-2-one.

Molecular Properties

Compound Name1-[(1-benzoyl-2,3-dihydroindol-5-yl)sulfonyl]-4-phenylimidazolidin-2-one
PubChem CID21224938
Molecular FormulaC24H21N3O4S
Molecular Weight447.52 g/mol
Exact Mass447.13
IUPAC Name1-[(1-benzoyl-2,3-dihydroindol-5-yl)sulfonyl]-4-phenylimidazolidin-2-one
SMILESO=C(c1ccccc1)N1CCc2cc(S(=O)(=O)N3CC(c4ccccc4)NC3=O)ccc21
InChIInChI=1S/C24H21N3O4S/c28-23(18-9-5-2-6-10-18)26-14-13-19-15-20(11-12-22(19)26)32(30,31)27-16-21(25-24(27)29)17-7-3-1-4-8-17/h1-12,15,21H,13-14,16H2,(H,25,29)
InChIKeyOXCLENVMHHTHLI-UHFFFAOYSA-N
XLogP3.34
TPSA86.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.52
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Isatin Sulfonamide 26
CID 9800285
1-methyl-2-oxo-N-(2-phenylethyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 1511494
1-Methyl-5-{[(phenylethyl)amino]sulfonyl}indolin-2-one
CID 3163725
Isatin Sulfonamide 25
CID 9863271
Isatin Sulfonamide 28
CID 9952756
N-[4-(acetylsulfamoyl)phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide
CID 2449571
3-(2,3-dihydroindol-1-ylsulfonyl)-N-[3-(dimethylsulfamoyl)phenyl]benzamide
CID 5031360
DW-2282 free base
CID 9870546
DW-2143 free base
CID 9935663
((+/-)-N-(4-{[(1-butyrylpyrrolidin-3-yl)amino]sulfonyl}-1-naphthyl)-2-methylbenzamide
CID 16105832
5-[[4-(4-Acetylphenyl)-1-piperazinyl]sulfonyl]-1,3-dihydroindol-2-one
CID 20969430
5-[2-(anilinomethyl)pyrrolidin-1-yl]sulfonyl-1H-indole-2,3-dione
CID 22456716

Frequently Asked Questions

What is the IUPAC name of 1-[(1-benzoyl-2,3-dihydroindol-5-yl)sulfonyl]-4-phenylimidazolidin-2-one?
The IUPAC name of 1-[(1-benzoyl-2,3-dihydroindol-5-yl)sulfonyl]-4-phenylimidazolidin-2-one (CID 21224938) is 1-[(1-benzoyl-2,3-dihydroindol-5-yl)sulfonyl]-4-phenylimidazolidin-2-one.
What is the SMILES notation for 1-[(1-benzoyl-2,3-dihydroindol-5-yl)sulfonyl]-4-phenylimidazolidin-2-one?
The canonical SMILES for 1-[(1-benzoyl-2,3-dihydroindol-5-yl)sulfonyl]-4-phenylimidazolidin-2-one is O=C(c1ccccc1)N1CCc2cc(S(=O)(=O)N3CC(c4ccccc4)NC3=O)ccc21.
What is the InChIKey of 1-[(1-benzoyl-2,3-dihydroindol-5-yl)sulfonyl]-4-phenylimidazolidin-2-one?
The InChIKey is OXCLENVMHHTHLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O4S/c28-23(18-9-5-2-6-10-18)26-14-13-19-15-20(11-12-22(19)26)32(30,31)27-16-21(25-24(27)29)17-7-3-1-4-8-17/h1-12,15,21H,13-14,16H2,(H,25,29).
What are the key properties of 1-[(1-benzoyl-2,3-dihydroindol-5-yl)sulfonyl]-4-phenylimidazolidin-2-one?
1-[(1-benzoyl-2,3-dihydroindol-5-yl)sulfonyl]-4-phenylimidazolidin-2-one has a molecular weight of 447.52 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-benzoyl-2,3-dihydroindol-5-yl)sulfonyl]-4-phenylimidazolidin-2-one is sourced from PubChem (CID 21224938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).