2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene

C34H24O2S3 — CID 102235498

IUPAC2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene
SMILESCOc1ccc2cc(-c3ccc(-c4ccc(-c5ccc(-c6ccc7cc(OC)ccc7c6)s5)s4)s3)ccc2c1
InChIInChI=1S/C34H24O2S3/c1-35-27-9-7-21-17-25(5-3-23(21)19-27)29-11-13-31(37-29)33-15-16-34(39-33)32-14-12-30(38-32)26-6-4-24-20-28(36-2)10-8-22(24)18-26/h3-20H,1-2H3
InChIKeyLQPLLQQHZVASOM-UHFFFAOYSA-N
MW560.77 g/mol
LogP10.86
Rot. Bonds6

About 2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene

2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene (PubChem CID 102235498) has the molecular formula C34H24O2S3 and a molecular weight of 560.77 g/mol. Its IUPAC name is 2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene.

Molecular Properties

Compound Name2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene
PubChem CID102235498
Molecular FormulaC34H24O2S3
Molecular Weight560.77 g/mol
Exact Mass560.09
IUPAC Name2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene
SMILESCOc1ccc2cc(-c3ccc(-c4ccc(-c5ccc(-c6ccc7cc(OC)ccc7c6)s5)s4)s3)ccc2c1
InChIInChI=1S/C34H24O2S3/c1-35-27-9-7-21-17-25(5-3-23(21)19-27)29-11-13-31(37-29)33-15-16-34(39-33)32-14-12-30(38-32)26-6-4-24-20-28(36-2)10-8-22(24)18-26/h3-20H,1-2H3
InChIKeyLQPLLQQHZVASOM-UHFFFAOYSA-N
XLogP10.86
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500560.77
LogP ≤ 510.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2,5-bis[5-[4-(4-methoxyphenyl)phenyl]thiophen-2-yl]thiophene
CID 132513911
2,5-bis[4-(4-methoxyphenyl)phenyl]thiophene
CID 16751334
2-methoxy-6-(4-methoxyphenyl)naphthalene
CID 11149734
methyl 6-[5-(4-methoxyphenyl)thiophen-2-yl]naphthalene-2-carboxylate
CID 69360767
2-methoxy-6-[6-[6-(6-methylnaphthalen-2-yl)naphthalen-2-yl]naphthalen-2-yl]naphthalene
CID 58556071
2-(4-methoxyphenyl)-5-[4-[5-[4-(trifluoromethyl)phenyl]thiophen-2-yl]phenyl]thiophene
CID 46181810
2-methoxy-6-phenylnaphthalene
CID 11253308
2-chloro-4-[5-(4-methoxyphenyl)thiophen-2-yl]pyridine
CID 51353922
2-[3-(4-methoxyphenyl)-5-(5-thiophen-2-ylthiophen-2-yl)phenyl]-5-thiophen-2-ylthiophene
CID 25194683
2-(4-chlorophenyl)-6-methoxynaphthalene
CID 45156517
2-(4-methoxyphenyl)-5-[10-[5-(4-methoxyphenyl)thiophen-2-yl]anthracen-9-yl]thiophene
CID 151477310
2-(4-methoxyphenyl)-6-methylnaphthalene
CID 15099897

Frequently Asked Questions

What is the IUPAC name of 2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene?
The IUPAC name of 2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene (CID 102235498) is 2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene.
What is the SMILES notation for 2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene?
The canonical SMILES for 2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene is COc1ccc2cc(-c3ccc(-c4ccc(-c5ccc(-c6ccc7cc(OC)ccc7c6)s5)s4)s3)ccc2c1.
What is the InChIKey of 2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene?
The InChIKey is LQPLLQQHZVASOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H24O2S3/c1-35-27-9-7-21-17-25(5-3-23(21)19-27)29-11-13-31(37-29)33-15-16-34(39-33)32-14-12-30(38-32)26-6-4-24-20-28(36-2)10-8-22(24)18-26/h3-20H,1-2H3.
What are the key properties of 2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene?
2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene has a molecular weight of 560.77 g/mol, XLogP of 10.86, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis[5-(6-methoxynaphthalen-2-yl)thiophen-2-yl]thiophene is sourced from PubChem (CID 102235498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).