4-ethyl-2-(4-methylphenyl)sulfanylphenol

C15H16OS — CID 22763953

IUPAC4-ethyl-2-(4-methylphenyl)sulfanylphenol
SMILESCCc1ccc(O)c(Sc2ccc(C)cc2)c1
InChIInChI=1S/C15H16OS/c1-3-12-6-9-14(16)15(10-12)17-13-7-4-11(2)5-8-13/h4-10,16H,3H2,1-2H3
InChIKeyAODAWKVPYUAOMX-UHFFFAOYSA-N
MW244.36 g/mol
LogP4.41
Rot. Bonds3

About 4-ethyl-2-(4-methylphenyl)sulfanylphenol

4-ethyl-2-(4-methylphenyl)sulfanylphenol (PubChem CID 22763953) has the molecular formula C15H16OS and a molecular weight of 244.36 g/mol. Its IUPAC name is 4-ethyl-2-(4-methylphenyl)sulfanylphenol.

Molecular Properties

Compound Name4-ethyl-2-(4-methylphenyl)sulfanylphenol
PubChem CID22763953
Molecular FormulaC15H16OS
Molecular Weight244.36 g/mol
Exact Mass244.09
IUPAC Name4-ethyl-2-(4-methylphenyl)sulfanylphenol
SMILESCCc1ccc(O)c(Sc2ccc(C)cc2)c1
InChIInChI=1S/C15H16OS/c1-3-12-6-9-14(16)15(10-12)17-13-7-4-11(2)5-8-13/h4-10,16H,3H2,1-2H3
InChIKeyAODAWKVPYUAOMX-UHFFFAOYSA-N
XLogP4.41
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.36
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-ethyl-2-(4-methylphenyl)sulfanylphenol 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-(4-chlorophenyl)sulfanyl-4-methylphenol
CID 21411344
4-(2,4-diethylphenyl)sulfanylphenol
CID 91879872
5-bromo-2-(4-ethylphenyl)sulfanylphenol
CID 91877717
4-(2-chloro-4-ethylphenyl)sulfanylphenol
CID 91879878
2-fluoro-4-(4-methylphenyl)sulfanylphenol
CID 23543387
bis(1-ethyl-4-methylbenzene);hydrate
CID 175281588
1-ethyl-4-methylbenzene;propane
CID 144580802
4-ethyl-1,2-dimethylbenzene;1,4-xylene
CID 142969887
[4-(4-ethylphenyl)sulfanylphenyl]-[4-(4-methylphenyl)sulfanylphenyl]-phenylsulfanium
CID 143787310
4-bromo-1-(4-ethylphenyl)sulfanyl-2-methylbenzene
CID 91877718
methyl 3-[4-hydroxy-3,5-bis[(4-methylphenyl)sulfanyl]phenyl]propanoate
CID 101010779
5-ethyl-2-(4-iodophenyl)sulfanylaniline
CID 91878146

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(4-methylphenyl)sulfanylphenol?
The IUPAC name of 4-ethyl-2-(4-methylphenyl)sulfanylphenol (CID 22763953) is 4-ethyl-2-(4-methylphenyl)sulfanylphenol.
What is the SMILES notation for 4-ethyl-2-(4-methylphenyl)sulfanylphenol?
The canonical SMILES for 4-ethyl-2-(4-methylphenyl)sulfanylphenol is CCc1ccc(O)c(Sc2ccc(C)cc2)c1.
What is the InChIKey of 4-ethyl-2-(4-methylphenyl)sulfanylphenol?
The InChIKey is AODAWKVPYUAOMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16OS/c1-3-12-6-9-14(16)15(10-12)17-13-7-4-11(2)5-8-13/h4-10,16H,3H2,1-2H3.
What are the key properties of 4-ethyl-2-(4-methylphenyl)sulfanylphenol?
4-ethyl-2-(4-methylphenyl)sulfanylphenol has a molecular weight of 244.36 g/mol, XLogP of 4.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(4-methylphenyl)sulfanylphenol is sourced from PubChem (CID 22763953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).