2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylic acid

C10H10N4O2S — CID 80568776

IUPAC2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylic acid
SMILESO=C(O)c1csc(N2CCn3ccnc3C2)n1
InChIInChI=1S/C10H10N4O2S/c15-9(16)7-6-17-10(12-7)14-4-3-13-2-1-11-8(13)5-14/h1-2,6H,3-5H2,(H,15,16)
InChIKeyJZODJCQICFKQGC-UHFFFAOYSA-N
MW250.28 g/mol
LogP1.06
Rot. Bonds2

About 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylic acid

2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylic acid (PubChem CID 80568776) has the molecular formula C10H10N4O2S and a molecular weight of 250.28 g/mol. Its IUPAC name is 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylic acid.

Molecular Properties

Compound Name2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylic acid
PubChem CID80568776
Molecular FormulaC10H10N4O2S
Molecular Weight250.28 g/mol
Exact Mass250.05
IUPAC Name2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylic acid
SMILESO=C(O)c1csc(N2CCn3ccnc3C2)n1
InChIInChI=1S/C10H10N4O2S/c15-9(16)7-6-17-10(12-7)14-4-3-13-2-1-11-8(13)5-14/h1-2,6H,3-5H2,(H,15,16)
InChIKeyJZODJCQICFKQGC-UHFFFAOYSA-N
XLogP1.06
TPSA71.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.28
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylic acid?
The IUPAC name of 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylic acid (CID 80568776) is 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylic acid.
What is the SMILES notation for 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylic acid?
The canonical SMILES for 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylic acid is O=C(O)c1csc(N2CCn3ccnc3C2)n1.
What is the InChIKey of 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylic acid?
The InChIKey is JZODJCQICFKQGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2S/c15-9(16)7-6-17-10(12-7)14-4-3-13-2-1-11-8(13)5-14/h1-2,6H,3-5H2,(H,15,16).
What are the key properties of 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylic acid?
2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylic acid has a molecular weight of 250.28 g/mol, XLogP of 1.06, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylic acid is sourced from PubChem (CID 80568776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).