1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole

C15H13Cl2NO2S — CID 42994759

IUPAC1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole
SMILESCC1Cc2ccccc2N1S(=O)(=O)c1c(Cl)cccc1Cl
InChIInChI=1S/C15H13Cl2NO2S/c1-10-9-11-5-2-3-8-14(11)18(10)21(19,20)15-12(16)6-4-7-13(15)17/h2-8,10H,9H2,1H3
InChIKeyKFAFSJJZKAWWCY-UHFFFAOYSA-N
MW342.25 g/mol
LogP4.13
Rot. Bonds2

About 1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole

1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole (PubChem CID 42994759) has the molecular formula C15H13Cl2NO2S and a molecular weight of 342.25 g/mol. Its IUPAC name is 1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole.

Molecular Properties

Compound Name1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole
PubChem CID42994759
Molecular FormulaC15H13Cl2NO2S
Molecular Weight342.25 g/mol
Exact Mass341.00
IUPAC Name1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole
SMILESCC1Cc2ccccc2N1S(=O)(=O)c1c(Cl)cccc1Cl
InChIInChI=1S/C15H13Cl2NO2S/c1-10-9-11-5-2-3-8-14(11)18(10)21(19,20)15-12(16)6-4-7-13(15)17/h2-8,10H,9H2,1H3
InChIKeyKFAFSJJZKAWWCY-UHFFFAOYSA-N
XLogP4.13
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.25
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]aniline
CID 43452427
6-methyl-5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-1H-pyrimidine-2,4-dione
CID 6624083
(2R)-2-methyl-1-[2,4,6-tri(propan-2-yl)phenyl]sulfonyl-2,3-dihydroindole
CID 27332586
(2S)-1-(2,5-dichloro-4-methoxyphenyl)sulfonyl-2-methyl-2,3-dihydroindole
CID 1179545
2-methyl-1-thiophen-2-ylsulfonyl-2,3-dihydroindole
CID 2943362
1-(5-chloro-2-methoxy-4-methylphenyl)sulfonyl-2-methyl-2,3-dihydroindole
CID 2978845
1-(4-chloro-2-methoxyphenyl)sulfonyl-2-methyl-2,3-dihydroindole
CID 4914481
N-[2-chloro-4-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]phenyl]acetamide
CID 23853086
(2R)-1-[(5-bromo-6-chloro-3-pyridinyl)sulfonyl]-2-methyl-2,3-dihydroindole
CID 1034220
[2-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]phenyl]hydrazine
CID 43454884
1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole
CID 3750553
4-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzonitrile
CID 24694007

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole?
The IUPAC name of 1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole (CID 42994759) is 1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole.
What is the SMILES notation for 1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole?
The canonical SMILES for 1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole is CC1Cc2ccccc2N1S(=O)(=O)c1c(Cl)cccc1Cl.
What is the InChIKey of 1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole?
The InChIKey is KFAFSJJZKAWWCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO2S/c1-10-9-11-5-2-3-8-14(11)18(10)21(19,20)15-12(16)6-4-7-13(15)17/h2-8,10H,9H2,1H3.
What are the key properties of 1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole?
1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole has a molecular weight of 342.25 g/mol, XLogP of 4.13, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dichlorophenyl)sulfonyl-2-methyl-2,3-dihydroindole is sourced from PubChem (CID 42994759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).