6-(1-benzylpyrazol-4-yl)-3-(2-chlorophenyl)imidazo[1,2-a]pyrazine

C22H16ClN5 — CID 155548210

IUPAC6-(1-benzylpyrazol-4-yl)-3-(2-chlorophenyl)imidazo[1,2-a]pyrazine
SMILESClc1ccccc1-c1cnc2cnc(-c3cnn(Cc4ccccc4)c3)cn12
InChIInChI=1S/C22H16ClN5/c23-19-9-5-4-8-18(19)21-11-25-22-12-24-20(15-28(21)22)17-10-26-27(14-17)13-16-6-2-1-3-7-16/h1-12,14-15H,13H2
InChIKeyJTZJYVHOIHCKMU-UHFFFAOYSA-N
MW385.86 g/mol
LogP4.96
Rot. Bonds4

About 6-(1-benzylpyrazol-4-yl)-3-(2-chlorophenyl)imidazo[1,2-a]pyrazine

6-(1-benzylpyrazol-4-yl)-3-(2-chlorophenyl)imidazo[1,2-a]pyrazine (PubChem CID 155548210) has the molecular formula C22H16ClN5 and a molecular weight of 385.86 g/mol. Its IUPAC name is 6-(1-benzylpyrazol-4-yl)-3-(2-chlorophenyl)imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name6-(1-benzylpyrazol-4-yl)-3-(2-chlorophenyl)imidazo[1,2-a]pyrazine
PubChem CID155548210
Molecular FormulaC22H16ClN5
Molecular Weight385.86 g/mol
Exact Mass385.11
IUPAC Name6-(1-benzylpyrazol-4-yl)-3-(2-chlorophenyl)imidazo[1,2-a]pyrazine
SMILESClc1ccccc1-c1cnc2cnc(-c3cnn(Cc4ccccc4)c3)cn12
InChIInChI=1S/C22H16ClN5/c23-19-9-5-4-8-18(19)21-11-25-22-12-24-20(15-28(21)22)17-10-26-27(14-17)13-16-6-2-1-3-7-16/h1-12,14-15H,13H2
InChIKeyJTZJYVHOIHCKMU-UHFFFAOYSA-N
XLogP4.96
TPSA48.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.86
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(1-benzylpyrazol-4-yl)-3-(2-chlorophenyl)imidazo[1,2-a]pyrazine?
The IUPAC name of 6-(1-benzylpyrazol-4-yl)-3-(2-chlorophenyl)imidazo[1,2-a]pyrazine (CID 155548210) is 6-(1-benzylpyrazol-4-yl)-3-(2-chlorophenyl)imidazo[1,2-a]pyrazine.
What is the SMILES notation for 6-(1-benzylpyrazol-4-yl)-3-(2-chlorophenyl)imidazo[1,2-a]pyrazine?
The canonical SMILES for 6-(1-benzylpyrazol-4-yl)-3-(2-chlorophenyl)imidazo[1,2-a]pyrazine is Clc1ccccc1-c1cnc2cnc(-c3cnn(Cc4ccccc4)c3)cn12.
What is the InChIKey of 6-(1-benzylpyrazol-4-yl)-3-(2-chlorophenyl)imidazo[1,2-a]pyrazine?
The InChIKey is JTZJYVHOIHCKMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16ClN5/c23-19-9-5-4-8-18(19)21-11-25-22-12-24-20(15-28(21)22)17-10-26-27(14-17)13-16-6-2-1-3-7-16/h1-12,14-15H,13H2.
What are the key properties of 6-(1-benzylpyrazol-4-yl)-3-(2-chlorophenyl)imidazo[1,2-a]pyrazine?
6-(1-benzylpyrazol-4-yl)-3-(2-chlorophenyl)imidazo[1,2-a]pyrazine has a molecular weight of 385.86 g/mol, XLogP of 4.96, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-benzylpyrazol-4-yl)-3-(2-chlorophenyl)imidazo[1,2-a]pyrazine is sourced from PubChem (CID 155548210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).