6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran

C30H18O4S2 — CID 145031011

IUPAC6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran
SMILESCc1ccc(-c2cc3cc4cc(-c5cc6cc7cc(-c8ccc(C)s8)oc7cc6o5)oc4cc3o2)s1
InChIInChI=1S/C30H18O4S2/c1-15-3-5-29(35-15)27-11-19-7-17-9-25(31-21(17)13-23(19)33-27)26-10-18-8-20-12-28(30-6-4-16(2)36-30)34-24(20)14-22(18)32-26/h3-14H,1-2H3
InChIKeyQBVSZCWQLXRWSH-UHFFFAOYSA-N
MW506.60 g/mol
LogP10.41
Rot. Bonds3

About 6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran

6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran (PubChem CID 145031011) has the molecular formula C30H18O4S2 and a molecular weight of 506.60 g/mol. Its IUPAC name is 6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran.

Molecular Properties

Compound Name6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran
PubChem CID145031011
Molecular FormulaC30H18O4S2
Molecular Weight506.60 g/mol
Exact Mass506.06
IUPAC Name6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran
SMILESCc1ccc(-c2cc3cc4cc(-c5cc6cc7cc(-c8ccc(C)s8)oc7cc6o5)oc4cc3o2)s1
InChIInChI=1S/C30H18O4S2/c1-15-3-5-29(35-15)27-11-19-7-17-9-25(31-21(17)13-23(19)33-27)26-10-18-8-20-12-28(30-6-4-16(2)36-30)34-24(20)14-22(18)32-26/h3-14H,1-2H3
InChIKeyQBVSZCWQLXRWSH-UHFFFAOYSA-N
XLogP10.41
TPSA52.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500506.60
LogP ≤ 510.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran with MolForge

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Related Compounds

2-(5-methylthiophen-2-yl)-1-benzofuran
CID 24744243
6-(3-methylphenyl)-2-[6-(3-methylphenyl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran
CID 145031024
ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene
CID 91463281
2-bromo-5-(5-methylthiophen-2-yl)-1,3-oxazole
CID 117259565
5-(5-methylthiophen-2-yl)-1,2-oxazole
CID 45099284
2,5-bis(5-methylthiophen-2-yl)thieno[3,2-b]thiophene
CID 71014682
7-bromo-2-(7-bromobenzo[f][1]benzofuran-2-yl)benzo[f][1]benzofuran
CID 71108528
2,5-bis(5-methylthiophen-2-yl)thieno[3,2-b]thiophene;ethane
CID 161142248
5-(5-methylthiophen-2-yl)-2-phenyl-1,3-oxazole
CID 14424350
6,17-bis(5-methylthiophen-2-yl)-5,18-dithiapentacyclo[11.7.0.02,10.04,8.015,19]icosa-1(20),2,4(8),6,9,11,13,15(19),16-nonaene
CID 122645046
5,14-bis(5-methylthiophen-2-yl)-12,22-dioxahexacyclo[11.7.1.14,20.02,11.03,8.017,21]docosa-1(20),2(11),3(8),4,6,9,13,15,17(21),18-decaene
CID 102424305
N-methyl-1-[5-(5-methyl-1-benzofuran-2-yl)-1,3-thiazol-2-yl]methanamine
CID 112755713

Frequently Asked Questions

What is the IUPAC name of 6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran?
The IUPAC name of 6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran (CID 145031011) is 6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran.
What is the SMILES notation for 6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran?
The canonical SMILES for 6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran is Cc1ccc(-c2cc3cc4cc(-c5cc6cc7cc(-c8ccc(C)s8)oc7cc6o5)oc4cc3o2)s1.
What is the InChIKey of 6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran?
The InChIKey is QBVSZCWQLXRWSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H18O4S2/c1-15-3-5-29(35-15)27-11-19-7-17-9-25(31-21(17)13-23(19)33-27)26-10-18-8-20-12-28(30-6-4-16(2)36-30)34-24(20)14-22(18)32-26/h3-14H,1-2H3.
What are the key properties of 6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran?
6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran has a molecular weight of 506.60 g/mol, XLogP of 10.41, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-methylthiophen-2-yl)-2-[6-(5-methylthiophen-2-yl)furo[3,2-f][1]benzofuran-2-yl]furo[3,2-f][1]benzofuran is sourced from PubChem (CID 145031011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).