2-(5,5-dipropyl-8-pyridin-2-yl-[1]benzogermolo[3,2-b]pyridin-2-yl)phenol

C28H28GeN2O — CID 153499183

IUPAC2-(5,5-dipropyl-8-pyridin-2-yl-[1]benzogermolo[3,2-b]pyridin-2-yl)phenol
SMILESCCC[Ge]1(CCC)c2ccc(-c3ccccn3)cc2-c2nc(-c3ccccc3O)ccc21
InChIInChI=1S/C28H28GeN2O/c1-3-16-29(17-4-2)23-13-12-20(25-10-7-8-18-30-25)19-22(23)28-24(29)14-15-26(31-28)21-9-5-6-11-27(21)32/h5-15,18-19,32H,3-4,16-17H2,1-2H3
InChIKeyWGLOTAQLNOKJAF-UHFFFAOYSA-N
MW481.16 g/mol
LogP5.88
Rot. Bonds6

About 2-(5,5-dipropyl-8-pyridin-2-yl-[1]benzogermolo[3,2-b]pyridin-2-yl)phenol

2-(5,5-dipropyl-8-pyridin-2-yl-[1]benzogermolo[3,2-b]pyridin-2-yl)phenol (PubChem CID 153499183) has the molecular formula C28H28GeN2O and a molecular weight of 481.16 g/mol. Its IUPAC name is 2-(5,5-dipropyl-8-pyridin-2-yl-[1]benzogermolo[3,2-b]pyridin-2-yl)phenol.

Molecular Properties

Compound Name2-(5,5-dipropyl-8-pyridin-2-yl-[1]benzogermolo[3,2-b]pyridin-2-yl)phenol
PubChem CID153499183
Molecular FormulaC28H28GeN2O
Molecular Weight481.16 g/mol
Exact Mass482.14
IUPAC Name2-(5,5-dipropyl-8-pyridin-2-yl-[1]benzogermolo[3,2-b]pyridin-2-yl)phenol
SMILESCCC[Ge]1(CCC)c2ccc(-c3ccccn3)cc2-c2nc(-c3ccccc3O)ccc21
InChIInChI=1S/C28H28GeN2O/c1-3-16-29(17-4-2)23-13-12-20(25-10-7-8-18-30-25)19-22(23)28-24(29)14-15-26(31-28)21-9-5-6-11-27(21)32/h5-15,18-19,32H,3-4,16-17H2,1-2H3
InChIKeyWGLOTAQLNOKJAF-UHFFFAOYSA-N
XLogP5.88
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms32
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500481.16
LogP ≤ 55.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5,5-dipropyl-8-pyridin-2-yl-[1]benzogermolo[3,2-b]pyridin-2-yl)phenol?
The IUPAC name of 2-(5,5-dipropyl-8-pyridin-2-yl-[1]benzogermolo[3,2-b]pyridin-2-yl)phenol (CID 153499183) is 2-(5,5-dipropyl-8-pyridin-2-yl-[1]benzogermolo[3,2-b]pyridin-2-yl)phenol.
What is the SMILES notation for 2-(5,5-dipropyl-8-pyridin-2-yl-[1]benzogermolo[3,2-b]pyridin-2-yl)phenol?
The canonical SMILES for 2-(5,5-dipropyl-8-pyridin-2-yl-[1]benzogermolo[3,2-b]pyridin-2-yl)phenol is CCC[Ge]1(CCC)c2ccc(-c3ccccn3)cc2-c2nc(-c3ccccc3O)ccc21.
What is the InChIKey of 2-(5,5-dipropyl-8-pyridin-2-yl-[1]benzogermolo[3,2-b]pyridin-2-yl)phenol?
The InChIKey is WGLOTAQLNOKJAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28GeN2O/c1-3-16-29(17-4-2)23-13-12-20(25-10-7-8-18-30-25)19-22(23)28-24(29)14-15-26(31-28)21-9-5-6-11-27(21)32/h5-15,18-19,32H,3-4,16-17H2,1-2H3.
What are the key properties of 2-(5,5-dipropyl-8-pyridin-2-yl-[1]benzogermolo[3,2-b]pyridin-2-yl)phenol?
2-(5,5-dipropyl-8-pyridin-2-yl-[1]benzogermolo[3,2-b]pyridin-2-yl)phenol has a molecular weight of 481.16 g/mol, XLogP of 5.88, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,5-dipropyl-8-pyridin-2-yl-[1]benzogermolo[3,2-b]pyridin-2-yl)phenol is sourced from PubChem (CID 153499183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).