ethyl 6,8-dibromoimidazo[1,2-a]pyrazine-2-carboxylate

C9H7Br2N3O2 — CID 19827087

IUPACethyl 6,8-dibromoimidazo[1,2-a]pyrazine-2-carboxylate
SMILESCCOC(=O)c1cn2cc(Br)nc(Br)c2n1
InChIInChI=1S/C9H7Br2N3O2/c1-2-16-9(15)5-3-14-4-6(10)13-7(11)8(14)12-5/h3-4H,2H2,1H3
InChIKeyONYDCYFHPPFRGX-UHFFFAOYSA-N
MW348.98 g/mol
LogP2.43
Rot. Bonds2

About ethyl 6,8-dibromoimidazo[1,2-a]pyrazine-2-carboxylate

ethyl 6,8-dibromoimidazo[1,2-a]pyrazine-2-carboxylate (PubChem CID 19827087) has the molecular formula C9H7Br2N3O2 and a molecular weight of 348.98 g/mol. Its IUPAC name is ethyl 6,8-dibromoimidazo[1,2-a]pyrazine-2-carboxylate.

Molecular Properties

Compound Nameethyl 6,8-dibromoimidazo[1,2-a]pyrazine-2-carboxylate
PubChem CID19827087
Molecular FormulaC9H7Br2N3O2
Molecular Weight348.98 g/mol
Exact Mass346.89
IUPAC Nameethyl 6,8-dibromoimidazo[1,2-a]pyrazine-2-carboxylate
SMILESCCOC(=O)c1cn2cc(Br)nc(Br)c2n1
InChIInChI=1S/C9H7Br2N3O2/c1-2-16-9(15)5-3-14-4-6(10)13-7(11)8(14)12-5/h3-4H,2H2,1H3
InChIKeyONYDCYFHPPFRGX-UHFFFAOYSA-N
XLogP2.43
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.98
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

Ethyl 2-methylimidazo(1,2-a)pyrazine-3-carboxylate
CID 13416932
Ethyl imidazo[1,2-a]pyrazine-2-carboxylate
CID 11845418
Imidazo[1,2-a]pyrazine-2-carboxylic acid
CID 12674617
Ethyl 5-bromoimidazo[1,2-a]pyrazine-2-carboxylate
CID 24212954
ethyl 5H,6H,7H,8H-imidazo(1,2-a)pyrimidine-2-carboxylate
CID 135779061
Methyl imidazo[1,2-A]pyrazine-2-carboxylate
CID 13247044
ethyl 5H,6H,7H,8H-imidazo[1,2-a]pyridine-2-carboxylate
CID 12745958
6-Bromoimidazo(1,2-a)pyrazine-2-carboxylic acid
CID 28875797
2-Methylimidazo(1,2-a)pyrazine-8-carboxylic acid
CID 63260407
Imidazo(1,2-a)pyrazine-3-carboxylic acid, ethyl ester
CID 68011844
Ethyl 3-bromoimidazo[1,5-a]pyrimidine-8-carboxylate
CID 71305760
Methyl 8-chloroimidazo[1,2-A]pyrazine-2-carboxylate
CID 71743177

Frequently Asked Questions

What is the IUPAC name of ethyl 6,8-dibromoimidazo[1,2-a]pyrazine-2-carboxylate?
The IUPAC name of ethyl 6,8-dibromoimidazo[1,2-a]pyrazine-2-carboxylate (CID 19827087) is ethyl 6,8-dibromoimidazo[1,2-a]pyrazine-2-carboxylate.
What is the SMILES notation for ethyl 6,8-dibromoimidazo[1,2-a]pyrazine-2-carboxylate?
The canonical SMILES for ethyl 6,8-dibromoimidazo[1,2-a]pyrazine-2-carboxylate is CCOC(=O)c1cn2cc(Br)nc(Br)c2n1.
What is the InChIKey of ethyl 6,8-dibromoimidazo[1,2-a]pyrazine-2-carboxylate?
The InChIKey is ONYDCYFHPPFRGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7Br2N3O2/c1-2-16-9(15)5-3-14-4-6(10)13-7(11)8(14)12-5/h3-4H,2H2,1H3.
What are the key properties of ethyl 6,8-dibromoimidazo[1,2-a]pyrazine-2-carboxylate?
ethyl 6,8-dibromoimidazo[1,2-a]pyrazine-2-carboxylate has a molecular weight of 348.98 g/mol, XLogP of 2.43, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 6,8-dibromoimidazo[1,2-a]pyrazine-2-carboxylate is sourced from PubChem (CID 19827087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).