2-(2,3-difluoro-4-methoxyphenyl)-5-(4-methoxyphenyl)thiophene

C18H14F2O2S — CID 141443240

IUPAC2-(2,3-difluoro-4-methoxyphenyl)-5-(4-methoxyphenyl)thiophene
SMILESCOc1ccc(-c2ccc(-c3ccc(OC)c(F)c3F)s2)cc1
InChIInChI=1S/C18H14F2O2S/c1-21-12-5-3-11(4-6-12)15-9-10-16(23-15)13-7-8-14(22-2)18(20)17(13)19/h3-10H,1-2H3
InChIKeySPVCMPHLJYUIJK-UHFFFAOYSA-N
MW332.37 g/mol
LogP5.38
Rot. Bonds4

About 2-(2,3-difluoro-4-methoxyphenyl)-5-(4-methoxyphenyl)thiophene

2-(2,3-difluoro-4-methoxyphenyl)-5-(4-methoxyphenyl)thiophene (PubChem CID 141443240) has the molecular formula C18H14F2O2S and a molecular weight of 332.37 g/mol. Its IUPAC name is 2-(2,3-difluoro-4-methoxyphenyl)-5-(4-methoxyphenyl)thiophene.

Molecular Properties

Compound Name2-(2,3-difluoro-4-methoxyphenyl)-5-(4-methoxyphenyl)thiophene
PubChem CID141443240
Molecular FormulaC18H14F2O2S
Molecular Weight332.37 g/mol
Exact Mass332.07
IUPAC Name2-(2,3-difluoro-4-methoxyphenyl)-5-(4-methoxyphenyl)thiophene
SMILESCOc1ccc(-c2ccc(-c3ccc(OC)c(F)c3F)s2)cc1
InChIInChI=1S/C18H14F2O2S/c1-21-12-5-3-11(4-6-12)15-9-10-16(23-15)13-7-8-14(22-2)18(20)17(13)19/h3-10H,1-2H3
InChIKeySPVCMPHLJYUIJK-UHFFFAOYSA-N
XLogP5.38
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.37
LogP ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-bis[4-(4-methoxyphenyl)phenyl]thiophene
CID 16751334
2,5-bis[5-[4-(4-methoxyphenyl)phenyl]thiophen-2-yl]thiophene
CID 132513911
2-(4-methoxyphenyl)-5-[4-[5-[4-(trifluoromethyl)phenyl]thiophen-2-yl]phenyl]thiophene
CID 46181810
2,3-difluoro-1-[2-fluoro-4-(4-methylphenyl)phenyl]-4-methoxybenzene;ethane
CID 142330852
2-(4-methoxyphenyl)-5-[10-[5-(4-methoxyphenyl)thiophen-2-yl]anthracen-9-yl]thiophene
CID 151477310
2-ethyl-5-(4-methoxyphenyl)thiophene
CID 21064460
2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene
CID 102235498
2-(3-methoxyphenyl)-5-(4-methoxy-3-phenylphenyl)thiophene
CID 44542351
2-[4-(4-ethoxy-2,3-difluorophenyl)phenyl]-5-methylthiophene
CID 172603717
2-(3-fluoro-4-methoxyphenyl)-5-(3-fluoro-5-methoxyphenyl)thiophene
CID 44543106
[5-(4-methoxyphenyl)thiophen-2-yl]-trimethylsilane
CID 135013894
5-(4-methoxyphenyl)-N-methylthiophen-2-amine
CID 82073086

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluoro-4-methoxyphenyl)-5-(4-methoxyphenyl)thiophene?
The IUPAC name of 2-(2,3-difluoro-4-methoxyphenyl)-5-(4-methoxyphenyl)thiophene (CID 141443240) is 2-(2,3-difluoro-4-methoxyphenyl)-5-(4-methoxyphenyl)thiophene.
What is the SMILES notation for 2-(2,3-difluoro-4-methoxyphenyl)-5-(4-methoxyphenyl)thiophene?
The canonical SMILES for 2-(2,3-difluoro-4-methoxyphenyl)-5-(4-methoxyphenyl)thiophene is COc1ccc(-c2ccc(-c3ccc(OC)c(F)c3F)s2)cc1.
What is the InChIKey of 2-(2,3-difluoro-4-methoxyphenyl)-5-(4-methoxyphenyl)thiophene?
The InChIKey is SPVCMPHLJYUIJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F2O2S/c1-21-12-5-3-11(4-6-12)15-9-10-16(23-15)13-7-8-14(22-2)18(20)17(13)19/h3-10H,1-2H3.
What are the key properties of 2-(2,3-difluoro-4-methoxyphenyl)-5-(4-methoxyphenyl)thiophene?
2-(2,3-difluoro-4-methoxyphenyl)-5-(4-methoxyphenyl)thiophene has a molecular weight of 332.37 g/mol, XLogP of 5.38, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluoro-4-methoxyphenyl)-5-(4-methoxyphenyl)thiophene is sourced from PubChem (CID 141443240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).