3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran

C15H11FO2S — CID 57417549

IUPAC3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran
SMILESCc1oc2ccccc2c1S(=O)c1ccc(F)cc1
InChIInChI=1S/C15H11FO2S/c1-10-15(13-4-2-3-5-14(13)18-10)19(17)12-8-6-11(16)7-9-12/h2-9H,1H3
InChIKeySPAZZQUPNPBBOW-UHFFFAOYSA-N
MW274.32 g/mol
LogP4.05
Rot. Bonds2

About 3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran

3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran (PubChem CID 57417549) has the molecular formula C15H11FO2S and a molecular weight of 274.32 g/mol. Its IUPAC name is 3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran.

Molecular Properties

Compound Name3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran
PubChem CID57417549
Molecular FormulaC15H11FO2S
Molecular Weight274.32 g/mol
Exact Mass274.05
IUPAC Name3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran
SMILESCc1oc2ccccc2c1S(=O)c1ccc(F)cc1
InChIInChI=1S/C15H11FO2S/c1-10-15(13-4-2-3-5-14(13)18-10)19(17)12-8-6-11(16)7-9-12/h2-9H,1H3
InChIKeySPAZZQUPNPBBOW-UHFFFAOYSA-N
XLogP4.05
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Benzofuran-2-Sulfonamide
CID 10750432
4-(1-Benzofuran-2-yl)benzenesulfonamide
CID 127029022
2-(4-Fluorophenyl)-3-(4-methylsulfonylphenyl)-1-benzofuran
CID 155536520
1-(8-fluoro-4H-thieno[3,2-c]chromen-2-yl)ethan-1-one
CID 2740073
2-(4-Fluorophenyl)benzofuran
CID 11816674
1-(1-Benzofuran-2-yl)-2-(phenylsulfonyl)ethanone
CID 15146467
3-(3-Fluoro-4-methoxy-phenyl)-2-(4-methanesulfonyl-phenyl)-benzofuran
CID 44316044
8-Oxatricyclo(7.4.0.0,2,7)trideca-1(9),2(7),3,5,10,12-hexaene-4-sulfonyl chloride
CID 2758030
Benzothiopheno[3,2-b]chromen-11-one
CID 11184312
1-(1-Benzofuran-2-yl)-2-methylsulfinylethanone
CID 45104335
(E)-3-(1-benzofuran-2-yl)-1-(4-fluorophenyl)prop-2-en-1-one
CID 89725419
3-(4-Fluoro-phenyl)-2-(4-methanesulfonyl-phenyl)-benzofuran
CID 44316046

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran?
The IUPAC name of 3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran (CID 57417549) is 3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran.
What is the SMILES notation for 3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran?
The canonical SMILES for 3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran is Cc1oc2ccccc2c1S(=O)c1ccc(F)cc1.
What is the InChIKey of 3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran?
The InChIKey is SPAZZQUPNPBBOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FO2S/c1-10-15(13-4-2-3-5-14(13)18-10)19(17)12-8-6-11(16)7-9-12/h2-9H,1H3.
What are the key properties of 3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran?
3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran has a molecular weight of 274.32 g/mol, XLogP of 4.05, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)sulfinyl-2-methyl-1-benzofuran is sourced from PubChem (CID 57417549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).