6-bromo-8-(4-phenylpyrazol-1-yl)imidazo[1,2-a]pyrazine

C15H10BrN5 — CID 79954506

IUPAC6-bromo-8-(4-phenylpyrazol-1-yl)imidazo[1,2-a]pyrazine
SMILESBrc1cn2ccnc2c(-n2cc(-c3ccccc3)cn2)n1
InChIInChI=1S/C15H10BrN5/c16-13-10-20-7-6-17-14(20)15(19-13)21-9-12(8-18-21)11-4-2-1-3-5-11/h1-10H
InChIKeyFXACXNGCPKHMLK-UHFFFAOYSA-N
MW340.18 g/mol
LogP3.34
Rot. Bonds2

About 6-bromo-8-(4-phenylpyrazol-1-yl)imidazo[1,2-a]pyrazine

6-bromo-8-(4-phenylpyrazol-1-yl)imidazo[1,2-a]pyrazine (PubChem CID 79954506) has the molecular formula C15H10BrN5 and a molecular weight of 340.18 g/mol. Its IUPAC name is 6-bromo-8-(4-phenylpyrazol-1-yl)imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name6-bromo-8-(4-phenylpyrazol-1-yl)imidazo[1,2-a]pyrazine
PubChem CID79954506
Molecular FormulaC15H10BrN5
Molecular Weight340.18 g/mol
Exact Mass339.01
IUPAC Name6-bromo-8-(4-phenylpyrazol-1-yl)imidazo[1,2-a]pyrazine
SMILESBrc1cn2ccnc2c(-n2cc(-c3ccccc3)cn2)n1
InChIInChI=1S/C15H10BrN5/c16-13-10-20-7-6-17-14(20)15(19-13)21-9-12(8-18-21)11-4-2-1-3-5-11/h1-10H
InChIKeyFXACXNGCPKHMLK-UHFFFAOYSA-N
XLogP3.34
TPSA48.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.18
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-(4-phenylpyrazol-1-yl)imidazo[1,2-a]pyrazine?
The IUPAC name of 6-bromo-8-(4-phenylpyrazol-1-yl)imidazo[1,2-a]pyrazine (CID 79954506) is 6-bromo-8-(4-phenylpyrazol-1-yl)imidazo[1,2-a]pyrazine.
What is the SMILES notation for 6-bromo-8-(4-phenylpyrazol-1-yl)imidazo[1,2-a]pyrazine?
The canonical SMILES for 6-bromo-8-(4-phenylpyrazol-1-yl)imidazo[1,2-a]pyrazine is Brc1cn2ccnc2c(-n2cc(-c3ccccc3)cn2)n1.
What is the InChIKey of 6-bromo-8-(4-phenylpyrazol-1-yl)imidazo[1,2-a]pyrazine?
The InChIKey is FXACXNGCPKHMLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrN5/c16-13-10-20-7-6-17-14(20)15(19-13)21-9-12(8-18-21)11-4-2-1-3-5-11/h1-10H.
What are the key properties of 6-bromo-8-(4-phenylpyrazol-1-yl)imidazo[1,2-a]pyrazine?
6-bromo-8-(4-phenylpyrazol-1-yl)imidazo[1,2-a]pyrazine has a molecular weight of 340.18 g/mol, XLogP of 3.34, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-(4-phenylpyrazol-1-yl)imidazo[1,2-a]pyrazine is sourced from PubChem (CID 79954506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).