4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol

C19H13BrN2O — CID 155115095

IUPAC4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol
SMILESOc1ccc(Br)cc1-c1nc(-c2ccccc2)n2ccccc12
InChIInChI=1S/C19H13BrN2O/c20-14-9-10-17(23)15(12-14)18-16-8-4-5-11-22(16)19(21-18)13-6-2-1-3-7-13/h1-12,23H
InChIKeyBZWXOYMGCFERDX-UHFFFAOYSA-N
MW365.23 g/mol
LogP5.14
Rot. Bonds2

About 4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol

4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol (PubChem CID 155115095) has the molecular formula C19H13BrN2O and a molecular weight of 365.23 g/mol. Its IUPAC name is 4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol.

Molecular Properties

Compound Name4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol
PubChem CID155115095
Molecular FormulaC19H13BrN2O
Molecular Weight365.23 g/mol
Exact Mass364.02
IUPAC Name4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol
SMILESOc1ccc(Br)cc1-c1nc(-c2ccccc2)n2ccccc12
InChIInChI=1S/C19H13BrN2O/c20-14-9-10-17(23)15(12-14)18-16-8-4-5-11-22(16)19(21-18)13-6-2-1-3-7-13/h1-12,23H
InChIKeyBZWXOYMGCFERDX-UHFFFAOYSA-N
XLogP5.14
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.23
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol?
The IUPAC name of 4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol (CID 155115095) is 4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol.
What is the SMILES notation for 4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol?
The canonical SMILES for 4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol is Oc1ccc(Br)cc1-c1nc(-c2ccccc2)n2ccccc12.
What is the InChIKey of 4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol?
The InChIKey is BZWXOYMGCFERDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13BrN2O/c20-14-9-10-17(23)15(12-14)18-16-8-4-5-11-22(16)19(21-18)13-6-2-1-3-7-13/h1-12,23H.
What are the key properties of 4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol?
4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol has a molecular weight of 365.23 g/mol, XLogP of 5.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol is sourced from PubChem (CID 155115095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).