2-(1-phenyl-5-thiophen-2-ylphosphol-2-yl)thiophene

C18H13PS2 — CID 102189631

IUPAC2-(1-phenyl-5-thiophen-2-ylphosphol-2-yl)thiophene
SMILESc1ccc(-p2c(-c3cccs3)ccc2-c2cccs2)cc1
InChIInChI=1S/C18H13PS2/c1-2-6-14(7-3-1)19-15(17-8-4-12-20-17)10-11-16(19)18-9-5-13-21-18/h1-13H
InChIKeyRNWNVRXLXUUTSS-UHFFFAOYSA-N
MW324.41 g/mol
LogP7.12
Rot. Bonds3

About 2-(1-phenyl-5-thiophen-2-ylphosphol-2-yl)thiophene

2-(1-phenyl-5-thiophen-2-ylphosphol-2-yl)thiophene (PubChem CID 102189631) has the molecular formula C18H13PS2 and a molecular weight of 324.41 g/mol. Its IUPAC name is 2-(1-phenyl-5-thiophen-2-ylphosphol-2-yl)thiophene.

Molecular Properties

Compound Name2-(1-phenyl-5-thiophen-2-ylphosphol-2-yl)thiophene
PubChem CID102189631
Molecular FormulaC18H13PS2
Molecular Weight324.41 g/mol
Exact Mass324.02
IUPAC Name2-(1-phenyl-5-thiophen-2-ylphosphol-2-yl)thiophene
SMILESc1ccc(-p2c(-c3cccs3)ccc2-c2cccs2)cc1
InChIInChI=1S/C18H13PS2/c1-2-6-14(7-3-1)19-15(17-8-4-12-20-17)10-11-16(19)18-9-5-13-21-18/h1-13H
InChIKeyRNWNVRXLXUUTSS-UHFFFAOYSA-N
XLogP7.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.41
LogP ≤ 57.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-phenyl-5-thiophen-2-ylphosphol-2-yl)thiophene?
The IUPAC name of 2-(1-phenyl-5-thiophen-2-ylphosphol-2-yl)thiophene (CID 102189631) is 2-(1-phenyl-5-thiophen-2-ylphosphol-2-yl)thiophene.
What is the SMILES notation for 2-(1-phenyl-5-thiophen-2-ylphosphol-2-yl)thiophene?
The canonical SMILES for 2-(1-phenyl-5-thiophen-2-ylphosphol-2-yl)thiophene is c1ccc(-p2c(-c3cccs3)ccc2-c2cccs2)cc1.
What is the InChIKey of 2-(1-phenyl-5-thiophen-2-ylphosphol-2-yl)thiophene?
The InChIKey is RNWNVRXLXUUTSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13PS2/c1-2-6-14(7-3-1)19-15(17-8-4-12-20-17)10-11-16(19)18-9-5-13-21-18/h1-13H.
What are the key properties of 2-(1-phenyl-5-thiophen-2-ylphosphol-2-yl)thiophene?
2-(1-phenyl-5-thiophen-2-ylphosphol-2-yl)thiophene has a molecular weight of 324.41 g/mol, XLogP of 7.12, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-phenyl-5-thiophen-2-ylphosphol-2-yl)thiophene is sourced from PubChem (CID 102189631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).