1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole

C15H13F2NO2S — CID 3750553

IUPAC1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole
SMILESCC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)cc1F
InChIInChI=1S/C15H13F2NO2S/c1-10-8-11-4-2-3-5-14(11)18(10)21(19,20)15-7-6-12(16)9-13(15)17/h2-7,9-10H,8H2,1H3
InChIKeyUCEGEBPZWZHXNX-UHFFFAOYSA-N
MW309.34 g/mol
LogP3.10
Rot. Bonds2

About 1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole

1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole (PubChem CID 3750553) has the molecular formula C15H13F2NO2S and a molecular weight of 309.34 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole
PubChem CID3750553
Molecular FormulaC15H13F2NO2S
Molecular Weight309.34 g/mol
Exact Mass309.06
IUPAC Name1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole
SMILESCC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)cc1F
InChIInChI=1S/C15H13F2NO2S/c1-10-8-11-4-2-3-5-14(11)18(10)21(19,20)15-7-6-12(16)9-13(15)17/h2-7,9-10H,8H2,1H3
InChIKeyUCEGEBPZWZHXNX-UHFFFAOYSA-N
XLogP3.10
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.34
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole-5-sulfonamide
CID 24556080
3-fluoro-4-methyl-5-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzoic acid
CID 167757923
2-fluoro-4-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]aniline
CID 82845026
(2S)-1-(4-chloro-2-fluorophenyl)sulfonyl-2-methyl-3,4-dihydro-2H-quinoline
CID 8500097
1-(2-fluorophenyl)sulfonyl-2-methyl-2,3-dihydroindol-5-amine
CID 43551065
1-(4-chloro-2-methoxyphenyl)sulfonyl-2-methyl-2,3-dihydroindole
CID 4914481
(2S)-1-(2-fluorophenyl)sulfonyl-2-methyl-3,4-dihydro-2H-quinoline
CID 8500021
(2R)-1-(5-bromo-2-methylphenyl)sulfonyl-2-methyl-2,3-dihydroindole
CID 8511937
[2-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]phenyl]hydrazine
CID 43454884
1-(2,4-dimethoxyphenyl)sulfonyl-2-methyl-2,3-dihydroindole
CID 19683272
(2S)-1-(4-methoxy-2-methylphenyl)sulfonyl-2-methyl-2,3-dihydroindole
CID 7456409
1-(4-bromo-2-ethylphenyl)sulfonyl-2-methyl-2,3-dihydroindole
CID 4986555

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole?
The IUPAC name of 1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole (CID 3750553) is 1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole.
What is the SMILES notation for 1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole?
The canonical SMILES for 1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole is CC1Cc2ccccc2N1S(=O)(=O)c1ccc(F)cc1F.
What is the InChIKey of 1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole?
The InChIKey is UCEGEBPZWZHXNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO2S/c1-10-8-11-4-2-3-5-14(11)18(10)21(19,20)15-7-6-12(16)9-13(15)17/h2-7,9-10H,8H2,1H3.
What are the key properties of 1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole?
1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole has a molecular weight of 309.34 g/mol, XLogP of 3.10, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)sulfonyl-2-methyl-2,3-dihydroindole is sourced from PubChem (CID 3750553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).