5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene

C32H30S2 — CID 153324384

IUPAC5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene
SMILESCC(C)c1sc(-c2ccccc2)cc1-c1ccccc1-c1cc(-c2ccccc2)sc1C(C)C
InChIInChI=1S/C32H30S2/c1-21(2)31-27(19-29(33-31)23-13-7-5-8-14-23)25-17-11-12-18-26(25)28-20-30(34-32(28)22(3)4)24-15-9-6-10-16-24/h5-22H,1-4H3
InChIKeyQLRISYSFOHHNSW-UHFFFAOYSA-N
MW478.73 g/mol
LogP10.72
Rot. Bonds6

About 5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene

5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene (PubChem CID 153324384) has the molecular formula C32H30S2 and a molecular weight of 478.73 g/mol. Its IUPAC name is 5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene.

Molecular Properties

Compound Name5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene
PubChem CID153324384
Molecular FormulaC32H30S2
Molecular Weight478.73 g/mol
Exact Mass478.18
IUPAC Name5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene
SMILESCC(C)c1sc(-c2ccccc2)cc1-c1ccccc1-c1cc(-c2ccccc2)sc1C(C)C
InChIInChI=1S/C32H30S2/c1-21(2)31-27(19-29(33-31)23-13-7-5-8-14-23)25-17-11-12-18-26(25)28-20-30(34-32(28)22(3)4)24-15-9-6-10-16-24/h5-22H,1-4H3
InChIKeyQLRISYSFOHHNSW-UHFFFAOYSA-N
XLogP10.72
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms34
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500478.73
LogP ≤ 510.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene?
The IUPAC name of 5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene (CID 153324384) is 5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene.
What is the SMILES notation for 5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene?
The canonical SMILES for 5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene is CC(C)c1sc(-c2ccccc2)cc1-c1ccccc1-c1cc(-c2ccccc2)sc1C(C)C.
What is the InChIKey of 5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene?
The InChIKey is QLRISYSFOHHNSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H30S2/c1-21(2)31-27(19-29(33-31)23-13-7-5-8-14-23)25-17-11-12-18-26(25)28-20-30(34-32(28)22(3)4)24-15-9-6-10-16-24/h5-22H,1-4H3.
What are the key properties of 5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene?
5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene has a molecular weight of 478.73 g/mol, XLogP of 10.72, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-3-[2-(5-phenyl-2-propan-2-ylthiophen-3-yl)phenyl]-2-propan-2-ylthiophene is sourced from PubChem (CID 153324384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).