2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-methylbenzene

C15H16O2S — CID 18738952

IUPAC2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-methylbenzene
SMILESCOc1ccc(Sc2ccc(C)cc2OC)cc1
InChIInChI=1S/C15H16O2S/c1-11-4-9-15(14(10-11)17-3)18-13-7-5-12(16-2)6-8-13/h4-10H,1-3H3
InChIKeyDRSLIMFKOBMEGS-UHFFFAOYSA-N
MW260.36 g/mol
LogP4.16
Rot. Bonds4

About 2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-methylbenzene

2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-methylbenzene (PubChem CID 18738952) has the molecular formula C15H16O2S and a molecular weight of 260.36 g/mol. Its IUPAC name is 2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-methylbenzene.

Molecular Properties

Compound Name2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-methylbenzene
PubChem CID18738952
Molecular FormulaC15H16O2S
Molecular Weight260.36 g/mol
Exact Mass260.09
IUPAC Name2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-methylbenzene
SMILESCOc1ccc(Sc2ccc(C)cc2OC)cc1
InChIInChI=1S/C15H16O2S/c1-11-4-9-15(14(10-11)17-3)18-13-7-5-12(16-2)6-8-13/h4-10H,1-3H3
InChIKeyDRSLIMFKOBMEGS-UHFFFAOYSA-N
XLogP4.16
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-2-methoxy-1-(4-methoxyphenyl)sulfanylbenzene
CID 91879142
2-(4-methoxyphenyl)sulfanyl-5-methylbenzonitrile
CID 114017345
[2-(4-methoxyphenyl)sulfanyl-5-methylphenyl]methanamine
CID 107931436
2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-nitrobenzene
CID 91878907
S-(2-methoxy-4-methylphenyl)thiohydroxylamine
CID 142317823
1-[4-(2,4-dimethylphenyl)sulfanylphenyl]-3-(4-methoxyphenyl)thiourea
CID 18226262
4-bromo-1-(4-methoxyphenyl)sulfanyl-2-methylbenzene
CID 91877415
2-(4-methoxyphenyl)sulfanyl-1,3,5-trimethylbenzene
CID 13052775
1-methoxy-4-(2-methylphenyl)sulfanylbenzene
CID 58715666
[5-methoxy-2-(4-methoxyphenyl)sulfanylphenyl]-dimethylsulfanium
CID 166590302
bis(4-methoxyphenyl)-[4-[4-[(4-methoxyphenyl)-(4-methylphenyl)sulfonio]phenyl]sulfanylphenyl]sulfanium
CID 159907768
5,8-bis[(4-methoxyphenyl)sulfanyl]phthalazine
CID 71186149

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-methylbenzene?
The IUPAC name of 2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-methylbenzene (CID 18738952) is 2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-methylbenzene.
What is the SMILES notation for 2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-methylbenzene?
The canonical SMILES for 2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-methylbenzene is COc1ccc(Sc2ccc(C)cc2OC)cc1.
What is the InChIKey of 2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-methylbenzene?
The InChIKey is DRSLIMFKOBMEGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2S/c1-11-4-9-15(14(10-11)17-3)18-13-7-5-12(16-2)6-8-13/h4-10H,1-3H3.
What are the key properties of 2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-methylbenzene?
2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-methylbenzene has a molecular weight of 260.36 g/mol, XLogP of 4.16, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(4-methoxyphenyl)sulfanyl-4-methylbenzene is sourced from PubChem (CID 18738952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).