2-naphthalen-1-yl-5-[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene

C36H22S4 — CID 14929397

IUPAC2-naphthalen-1-yl-5-[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene
SMILESc1ccc2c(-c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7cccc8ccccc78)s6)s5)s4)s3)cccc2c1
InChIInChI=1S/C36H22S4/c1-3-11-25-23(7-1)9-5-13-27(25)29-15-17-31(37-29)33-19-21-35(39-33)36-22-20-34(40-36)32-18-16-30(38-32)28-14-6-10-24-8-2-4-12-26(24)28/h1-22H
InChIKeyCFNAVXXQKKELSK-UHFFFAOYSA-N
MW582.84 g/mol
LogP12.57
Rot. Bonds5

About 2-naphthalen-1-yl-5-[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene

2-naphthalen-1-yl-5-[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene (PubChem CID 14929397) has the molecular formula C36H22S4 and a molecular weight of 582.84 g/mol. Its IUPAC name is 2-naphthalen-1-yl-5-[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene.

Molecular Properties

Compound Name2-naphthalen-1-yl-5-[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene
PubChem CID14929397
Molecular FormulaC36H22S4
Molecular Weight582.84 g/mol
Exact Mass582.06
IUPAC Name2-naphthalen-1-yl-5-[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene
SMILESc1ccc2c(-c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7cccc8ccccc78)s6)s5)s4)s3)cccc2c1
InChIInChI=1S/C36H22S4/c1-3-11-25-23(7-1)9-5-13-27(25)29-15-17-31(37-29)33-19-21-35(39-33)36-22-20-34(40-36)32-18-16-30(38-32)28-14-6-10-24-8-2-4-12-26(24)28/h1-22H
InChIKeyCFNAVXXQKKELSK-UHFFFAOYSA-N
XLogP12.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500582.84
LogP ≤ 512.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(5-naphthalen-1-ylthiophen-2-yl)methanamine
CID 43154300
methyl-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]-phenylazanium
CID 163669867
2-(3-methylphenyl)-5-naphthalen-1-ylthiophene
CID 59500404
2-[[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile
CID 177465509
tetrakis(1-naphthalen-1-ylnaphthalene);tetrahydrochloride
CID 173126408
1-naphthalen-1-ylnaphthalene;tetrahydrochloride
CID 68981096
CID 175282704
CID 175282704
bis(1-naphthalen-1-ylnaphthalene);phosphane
CID 175426418
1-naphthalen-1-yl-4-(5-naphthalen-1-ylnaphthalen-1-yl)naphthalene
CID 59169251
N-methyl-3-(5-naphthalen-1-ylthiophen-2-yl)-N-phenylaniline
CID 58281729
2-[(5-naphthalen-1-ylthiophen-2-yl)methyl]guanidine
CID 57103358
1-naphthalen-1-ylnaphthalene;ruthenium(2+);dichloride
CID 11327769

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-5-[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene?
The IUPAC name of 2-naphthalen-1-yl-5-[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene (CID 14929397) is 2-naphthalen-1-yl-5-[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene.
What is the SMILES notation for 2-naphthalen-1-yl-5-[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene?
The canonical SMILES for 2-naphthalen-1-yl-5-[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene is c1ccc2c(-c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7cccc8ccccc78)s6)s5)s4)s3)cccc2c1.
What is the InChIKey of 2-naphthalen-1-yl-5-[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene?
The InChIKey is CFNAVXXQKKELSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H22S4/c1-3-11-25-23(7-1)9-5-13-27(25)29-15-17-31(37-29)33-19-21-35(39-33)36-22-20-34(40-36)32-18-16-30(38-32)28-14-6-10-24-8-2-4-12-26(24)28/h1-22H.
What are the key properties of 2-naphthalen-1-yl-5-[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene?
2-naphthalen-1-yl-5-[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene has a molecular weight of 582.84 g/mol, XLogP of 12.57, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-5-[5-[5-(5-naphthalen-1-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophene is sourced from PubChem (CID 14929397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).