1-acetyl-N-(2,5-dichlorophenyl)-2,3-dihydroindole-5-sulfonamide

C16H14Cl2N2O3S — CID 3164268

IUPAC1-acetyl-N-(2,5-dichlorophenyl)-2,3-dihydroindole-5-sulfonamide
SMILESCC(=O)N1CCc2cc(S(=O)(=O)Nc3cc(Cl)ccc3Cl)ccc21
InChIInChI=1S/C16H14Cl2N2O3S/c1-10(21)20-7-6-11-8-13(3-5-16(11)20)24(22,23)19-15-9-12(17)2-4-14(15)18/h2-5,8-9,19H,6-7H2,1H3
InChIKeyBXYHRQXBDOXTEE-UHFFFAOYSA-N
MW385.27 g/mol
LogP3.70
Rot. Bonds3

About 1-acetyl-N-(2,5-dichlorophenyl)-2,3-dihydroindole-5-sulfonamide

1-acetyl-N-(2,5-dichlorophenyl)-2,3-dihydroindole-5-sulfonamide (PubChem CID 3164268) has the molecular formula C16H14Cl2N2O3S and a molecular weight of 385.27 g/mol. Its IUPAC name is 1-acetyl-N-(2,5-dichlorophenyl)-2,3-dihydroindole-5-sulfonamide.

Molecular Properties

Compound Name1-acetyl-N-(2,5-dichlorophenyl)-2,3-dihydroindole-5-sulfonamide
PubChem CID3164268
Molecular FormulaC16H14Cl2N2O3S
Molecular Weight385.27 g/mol
Exact Mass384.01
IUPAC Name1-acetyl-N-(2,5-dichlorophenyl)-2,3-dihydroindole-5-sulfonamide
SMILESCC(=O)N1CCc2cc(S(=O)(=O)Nc3cc(Cl)ccc3Cl)ccc21
InChIInChI=1S/C16H14Cl2N2O3S/c1-10(21)20-7-6-11-8-13(3-5-16(11)20)24(22,23)19-15-9-12(17)2-4-14(15)18/h2-5,8-9,19H,6-7H2,1H3
InChIKeyBXYHRQXBDOXTEE-UHFFFAOYSA-N
XLogP3.70
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.27
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-acetyl-N-(4-bromo-2-chlorophenyl)-2,3-dihydroindole-5-sulfonamide
CID 26488025
1-acetyl-N-(3-chloro-4-hydroxynaphthalen-1-yl)-2,3-dihydroindole-5-sulfonamide
CID 58565725
1-acetyl-N-(2-chlorophenyl)-2,3-dihydroindole-6-sulfonamide
CID 2940704
N-(1-acetyl-2,3-dihydroindol-5-yl)-2,5-dichlorobenzenesulfonamide
CID 42388553
1-acetyl-N-hydroxy-2,3-dihydroindole-5-sulfonamide
CID 82088952
1-acetyl-2,3-dihydroindole-5-sulfonohydrazide
CID 43476939
methyl 4-chloro-3-[[1-(cyclopropanecarbonyl)-2,3-dihydroindol-5-yl]sulfonylamino]benzoate
CID 100506055
N-[3-[(1-acetyl-2,3-dihydroindol-5-yl)sulfonylamino]phenyl]acetamide
CID 40687880
1-acetyl-N-(2,4-dimethylphenyl)-3,4-dihydro-2H-quinoline-6-sulfonamide
CID 7401545
1-acetyl-N-(5-chloro-2-methoxyphenyl)-2-methyl-2,3-dihydroindole-5-sulfonamide
CID 15996791
1-acetyl-N-(2-thiophen-2-ylphenyl)-2,3-dihydroindole-5-sulfonamide
CID 17469301
N-(5-chloro-2-methylphenyl)-1-(4-morpholin-4-yl-4-oxobutanoyl)-2,3-dihydroindole-5-sulfonamide
CID 53025546

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-(2,5-dichlorophenyl)-2,3-dihydroindole-5-sulfonamide?
The IUPAC name of 1-acetyl-N-(2,5-dichlorophenyl)-2,3-dihydroindole-5-sulfonamide (CID 3164268) is 1-acetyl-N-(2,5-dichlorophenyl)-2,3-dihydroindole-5-sulfonamide.
What is the SMILES notation for 1-acetyl-N-(2,5-dichlorophenyl)-2,3-dihydroindole-5-sulfonamide?
The canonical SMILES for 1-acetyl-N-(2,5-dichlorophenyl)-2,3-dihydroindole-5-sulfonamide is CC(=O)N1CCc2cc(S(=O)(=O)Nc3cc(Cl)ccc3Cl)ccc21.
What is the InChIKey of 1-acetyl-N-(2,5-dichlorophenyl)-2,3-dihydroindole-5-sulfonamide?
The InChIKey is BXYHRQXBDOXTEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2N2O3S/c1-10(21)20-7-6-11-8-13(3-5-16(11)20)24(22,23)19-15-9-12(17)2-4-14(15)18/h2-5,8-9,19H,6-7H2,1H3.
What are the key properties of 1-acetyl-N-(2,5-dichlorophenyl)-2,3-dihydroindole-5-sulfonamide?
1-acetyl-N-(2,5-dichlorophenyl)-2,3-dihydroindole-5-sulfonamide has a molecular weight of 385.27 g/mol, XLogP of 3.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-(2,5-dichlorophenyl)-2,3-dihydroindole-5-sulfonamide is sourced from PubChem (CID 3164268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).