4-chloro-2-(3-chlorophenyl)pyrazolo[1,5-a]pyrazine

C12H7Cl2N3 — CID 53331265

IUPAC4-chloro-2-(3-chlorophenyl)pyrazolo[1,5-a]pyrazine
SMILESClc1cccc(-c2cc3c(Cl)nccn3n2)c1
InChIInChI=1S/C12H7Cl2N3/c13-9-3-1-2-8(6-9)10-7-11-12(14)15-4-5-17(11)16-10/h1-7H
InChIKeyNGLJJYGXHIZWLD-UHFFFAOYSA-N
MW264.12 g/mol
LogP3.70
Rot. Bonds1

About 4-chloro-2-(3-chlorophenyl)pyrazolo[1,5-a]pyrazine

4-chloro-2-(3-chlorophenyl)pyrazolo[1,5-a]pyrazine (PubChem CID 53331265) has the molecular formula C12H7Cl2N3 and a molecular weight of 264.12 g/mol. Its IUPAC name is 4-chloro-2-(3-chlorophenyl)pyrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name4-chloro-2-(3-chlorophenyl)pyrazolo[1,5-a]pyrazine
PubChem CID53331265
Molecular FormulaC12H7Cl2N3
Molecular Weight264.12 g/mol
Exact Mass263.00
IUPAC Name4-chloro-2-(3-chlorophenyl)pyrazolo[1,5-a]pyrazine
SMILESClc1cccc(-c2cc3c(Cl)nccn3n2)c1
InChIInChI=1S/C12H7Cl2N3/c13-9-3-1-2-8(6-9)10-7-11-12(14)15-4-5-17(11)16-10/h1-7H
InChIKeyNGLJJYGXHIZWLD-UHFFFAOYSA-N
XLogP3.70
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.12
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(3-chlorophenyl)pyrazolo[1,5-a]pyrazine?
The IUPAC name of 4-chloro-2-(3-chlorophenyl)pyrazolo[1,5-a]pyrazine (CID 53331265) is 4-chloro-2-(3-chlorophenyl)pyrazolo[1,5-a]pyrazine.
What is the SMILES notation for 4-chloro-2-(3-chlorophenyl)pyrazolo[1,5-a]pyrazine?
The canonical SMILES for 4-chloro-2-(3-chlorophenyl)pyrazolo[1,5-a]pyrazine is Clc1cccc(-c2cc3c(Cl)nccn3n2)c1.
What is the InChIKey of 4-chloro-2-(3-chlorophenyl)pyrazolo[1,5-a]pyrazine?
The InChIKey is NGLJJYGXHIZWLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7Cl2N3/c13-9-3-1-2-8(6-9)10-7-11-12(14)15-4-5-17(11)16-10/h1-7H.
What are the key properties of 4-chloro-2-(3-chlorophenyl)pyrazolo[1,5-a]pyrazine?
4-chloro-2-(3-chlorophenyl)pyrazolo[1,5-a]pyrazine has a molecular weight of 264.12 g/mol, XLogP of 3.70, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(3-chlorophenyl)pyrazolo[1,5-a]pyrazine is sourced from PubChem (CID 53331265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).