5,7-dichloropyrido[3,4-b]pyrazine

C7H3Cl2N3 — CID 71742827

IUPAC5,7-dichloropyrido[3,4-b]pyrazine
SMILESClc1cc2nccnc2c(Cl)n1
InChIInChI=1S/C7H3Cl2N3/c8-5-3-4-6(7(9)12-5)11-2-1-10-4/h1-3H
InChIKeySNWNPXRUXXCDOM-UHFFFAOYSA-N
MW200.03 g/mol
LogP2.33
Rot. Bonds

About 5,7-dichloropyrido[3,4-b]pyrazine

5,7-dichloropyrido[3,4-b]pyrazine (PubChem CID 71742827) has the molecular formula C7H3Cl2N3 and a molecular weight of 200.03 g/mol. Its IUPAC name is 5,7-dichloropyrido[3,4-b]pyrazine.

Molecular Properties

Compound Name5,7-dichloropyrido[3,4-b]pyrazine
PubChem CID71742827
Molecular FormulaC7H3Cl2N3
Molecular Weight200.03 g/mol
Exact Mass198.97
IUPAC Name5,7-dichloropyrido[3,4-b]pyrazine
SMILESClc1cc2nccnc2c(Cl)n1
InChIInChI=1S/C7H3Cl2N3/c8-5-3-4-6(7(9)12-5)11-2-1-10-4/h1-3H
InChIKeySNWNPXRUXXCDOM-UHFFFAOYSA-N
XLogP2.33
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.03
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

1,5-Naphthyridine
CID 136070
2-Chloroquinoxaline
CID 238938
6-Chloroquinoxaline
CID 79534
2,6-Dichloroquinoxaline
CID 87748
1,5-Naphthyridin-3-amine
CID 589351
2,7-Dichloroquinoxaline
CID 2758223
5,8-Dichloropyrido[2,3-d]pyridazine
CID 279915
8-Chloro-(1,7)naphthyridine
CID 12342712
7-Chloropyrido[3,4-b]pyrazine
CID 44119674
1,5-Naphthyridin-4-amine
CID 589354
5-Chloro-2-methylpyrido(3,4-b)pyrazine
CID 12038531
2-(Trichloromethyl)quinoxaline
CID 10848114

Frequently Asked Questions

What is the IUPAC name of 5,7-dichloropyrido[3,4-b]pyrazine?
The IUPAC name of 5,7-dichloropyrido[3,4-b]pyrazine (CID 71742827) is 5,7-dichloropyrido[3,4-b]pyrazine.
What is the SMILES notation for 5,7-dichloropyrido[3,4-b]pyrazine?
The canonical SMILES for 5,7-dichloropyrido[3,4-b]pyrazine is Clc1cc2nccnc2c(Cl)n1.
What is the InChIKey of 5,7-dichloropyrido[3,4-b]pyrazine?
The InChIKey is SNWNPXRUXXCDOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3Cl2N3/c8-5-3-4-6(7(9)12-5)11-2-1-10-4/h1-3H.
What are the key properties of 5,7-dichloropyrido[3,4-b]pyrazine?
5,7-dichloropyrido[3,4-b]pyrazine has a molecular weight of 200.03 g/mol, XLogP of 2.33, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dichloropyrido[3,4-b]pyrazine is sourced from PubChem (CID 71742827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).