2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan

C13H11ClO2S — CID 102382887

IUPAC2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan
SMILESCc1ccc(S(=O)/C(Cl)=C/c2ccco2)cc1
InChIInChI=1S/C13H11ClO2S/c1-10-4-6-12(7-5-10)17(15)13(14)9-11-3-2-8-16-11/h2-9H,1H3/b13-9+
InChIKeyNGEUIFZFPIVXAB-UKTHLTGXSA-N
MW266.75 g/mol
LogP3.93
Rot. Bonds3

About 2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan

2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan (PubChem CID 102382887) has the molecular formula C13H11ClO2S and a molecular weight of 266.75 g/mol. Its IUPAC name is 2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan.

Molecular Properties

Compound Name2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan
PubChem CID102382887
Molecular FormulaC13H11ClO2S
Molecular Weight266.75 g/mol
Exact Mass266.02
IUPAC Name2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan
SMILESCc1ccc(S(=O)/C(Cl)=C/c2ccco2)cc1
InChIInChI=1S/C13H11ClO2S/c1-10-4-6-12(7-5-10)17(15)13(14)9-11-3-2-8-16-11/h2-9H,1H3/b13-9+
InChIKeyNGEUIFZFPIVXAB-UKTHLTGXSA-N
XLogP3.93
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.75
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan 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

2-[(E)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]thiophene
CID 102532992
2-[(Z)-2-chloro-2-[(S)-(4-methylphenyl)sulfinyl]ethenyl]thiophene
CID 11033348
1-[(Z)-1-chloro-2-(4-methylsulfanylphenyl)ethenyl]sulfinyl-4-methylbenzene
CID 102382885
(1S)-1-(furan-2-yl)-2,2-dimethyl-3-(4-methylphenyl)sulfinylbut-3-en-1-ol
CID 102180090
(Z)-2-bromo-3-(furan-2-yl)prop-2-enal
CID 14939228
1-[(1Z)-1-chloro-2-methylbuta-1,3-dienyl]sulfinyl-4-methylbenzene
CID 101380718
N-[(Z)-1-(furan-2-yl)-3-(4-methylanilino)-3-oxoprop-1-en-2-yl]-4-methylbenzamide
CID 40520569
[(1Z,3E)-1-chloro-4-(furan-2-yl)-3-methylbuta-1,3-dienyl] acetate
CID 42612904
(Z)-3-(furan-2-yl)-2-[(4-methylphenyl)sulfanylmethyl]prop-2-enenitrile
CID 177491829
(2E)-2-(furan-2-ylmethylidene)-3-methylbutanal
CID 82111259
(2E)-2-(furan-2-ylmethylidene)butanal
CID 6435826
(2Z)-2-(furan-2-ylmethylidene)-3-oxobutanoic acid
CID 18595236

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan?
The IUPAC name of 2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan (CID 102382887) is 2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan.
What is the SMILES notation for 2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan?
The canonical SMILES for 2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan is Cc1ccc(S(=O)/C(Cl)=C/c2ccco2)cc1.
What is the InChIKey of 2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan?
The InChIKey is NGEUIFZFPIVXAB-UKTHLTGXSA-N. The full InChI is InChI=1S/C13H11ClO2S/c1-10-4-6-12(7-5-10)17(15)13(14)9-11-3-2-8-16-11/h2-9H,1H3/b13-9+.
What are the key properties of 2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan?
2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan has a molecular weight of 266.75 g/mol, XLogP of 3.93, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]furan is sourced from PubChem (CID 102382887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).