[4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methanol

C15H16O2S — CID 63814136

IUPAC[4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methanol
SMILESCOc1ccc(Sc2ccc(CO)cc2C)cc1
InChIInChI=1S/C15H16O2S/c1-11-9-12(10-16)3-8-15(11)18-14-6-4-13(17-2)5-7-14/h3-9,16H,10H2,1-2H3
InChIKeyGVMPYJDSIGEXLV-UHFFFAOYSA-N
MW260.36 g/mol
LogP3.65
Rot. Bonds4

About [4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methanol

[4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methanol (PubChem CID 63814136) has the molecular formula C15H16O2S and a molecular weight of 260.36 g/mol. Its IUPAC name is [4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methanol.

Molecular Properties

Compound Name[4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methanol
PubChem CID63814136
Molecular FormulaC15H16O2S
Molecular Weight260.36 g/mol
Exact Mass260.09
IUPAC Name[4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methanol
SMILESCOc1ccc(Sc2ccc(CO)cc2C)cc1
InChIInChI=1S/C15H16O2S/c1-11-9-12(10-16)3-8-15(11)18-14-6-4-13(17-2)5-7-14/h3-9,16H,10H2,1-2H3
InChIKeyGVMPYJDSIGEXLV-UHFFFAOYSA-N
XLogP3.65
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(4-fluorophenyl)sulfanyl-3-methylphenyl]methanol
CID 63813527
N-[[4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methyl]propan-2-amine
CID 63806495
4-bromo-1-(4-methoxyphenyl)sulfanyl-2-methylbenzene
CID 91877415
[4-(2,4-dimethylphenyl)sulfanyl-3-methylphenyl]methanol
CID 63813831
[3-methyl-4-(2-methylphenyl)sulfanylphenyl]methanol
CID 63835401
[3-methyl-4-(4,5,6-trimethylpyrimidin-2-yl)sulfanylphenyl]methanol
CID 65041243
(4-methoxyphenyl)methanol
CID 7738
1-methoxy-4-(2-methylphenyl)sulfanylbenzene
CID 58715666
4-(4-methoxy-2-methylphenyl)sulfanylbenzoic acid
CID 91878618
4-ethyl-2-methoxy-1-(4-methoxyphenyl)sulfanylbenzene
CID 91879142
1-[4-(2,4-dimethylphenyl)sulfanylphenyl]-3-(4-methoxyphenyl)thiourea
CID 18226262
[4-bromo-2-(4-methoxyphenyl)sulfanylphenyl]methanol
CID 63812767

Frequently Asked Questions

What is the IUPAC name of [4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methanol?
The IUPAC name of [4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methanol (CID 63814136) is [4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methanol.
What is the SMILES notation for [4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methanol?
The canonical SMILES for [4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methanol is COc1ccc(Sc2ccc(CO)cc2C)cc1.
What is the InChIKey of [4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methanol?
The InChIKey is GVMPYJDSIGEXLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2S/c1-11-9-12(10-16)3-8-15(11)18-14-6-4-13(17-2)5-7-14/h3-9,16H,10H2,1-2H3.
What are the key properties of [4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methanol?
[4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methanol has a molecular weight of 260.36 g/mol, XLogP of 3.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-methoxyphenyl)sulfanyl-3-methylphenyl]methanol is sourced from PubChem (CID 63814136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).