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

C11H12N4O2S — CID 113307120

IUPACmethyl 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylate
SMILESCOC(=O)c1csc(N2CCn3ccnc3C2)n1
InChIInChI=1S/C11H12N4O2S/c1-17-10(16)8-7-18-11(13-8)15-5-4-14-3-2-12-9(14)6-15/h2-3,7H,4-6H2,1H3
InChIKeyAWAXTMBRJSQZDA-UHFFFAOYSA-N
MW264.31 g/mol
LogP1.15
Rot. Bonds2

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

methyl 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylate (PubChem CID 113307120) has the molecular formula C11H12N4O2S and a molecular weight of 264.31 g/mol. Its IUPAC name is methyl 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylate.

Molecular Properties

Compound Namemethyl 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylate
PubChem CID113307120
Molecular FormulaC11H12N4O2S
Molecular Weight264.31 g/mol
Exact Mass264.07
IUPAC Namemethyl 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylate
SMILESCOC(=O)c1csc(N2CCn3ccnc3C2)n1
InChIInChI=1S/C11H12N4O2S/c1-17-10(16)8-7-18-11(13-8)15-5-4-14-3-2-12-9(14)6-15/h2-3,7H,4-6H2,1H3
InChIKeyAWAXTMBRJSQZDA-UHFFFAOYSA-N
XLogP1.15
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze methyl 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylate with MolForge

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Related Compounds

methyl 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)pyrazine-2-carboxylate
CID 66449935
2-amino-2-[2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazol-4-yl]acetic acid
CID 113423096
ethyl 3-[2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazol-4-yl]propanoate
CID 103487542
methyl 2-(3,5-dioxopiperazin-1-yl)-1,3-thiazole-4-carboxylate
CID 115424764
1-[2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazol-4-yl]-N-ethylethanamine
CID 64544380
methyl 2-(3-azaspiro[5.5]undecan-3-yl)-1,3-thiazole-4-carboxylate
CID 115424343
methyl 2-(4-ethyl-3-methylpiperazin-1-yl)-1,3-thiazole-4-carboxylate
CID 113307122
methyl 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,3-thiazole-4-carboxylate
CID 104961725
methyl 2-(4-pyridin-2-yloxypiperidin-1-yl)-1,3-thiazole-4-carboxylate
CID 70845805
methyl 2-(1-oxa-8-azaspiro[4.5]decan-8-yl)-1,3-thiazole-4-carboxylate
CID 70845976
[2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol
CID 107511034
methyl 2-(2-methylpyrrolidin-1-yl)-1,3-thiazole-4-carboxylate
CID 115423691

Frequently Asked Questions

What is the IUPAC name of methyl 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylate?
The IUPAC name of methyl 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylate (CID 113307120) is methyl 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylate.
What is the SMILES notation for methyl 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylate?
The canonical SMILES for methyl 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylate is COC(=O)c1csc(N2CCn3ccnc3C2)n1.
What is the InChIKey of methyl 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylate?
The InChIKey is AWAXTMBRJSQZDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2S/c1-17-10(16)8-7-18-11(13-8)15-5-4-14-3-2-12-9(14)6-15/h2-3,7H,4-6H2,1H3.
What are the key properties of methyl 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylate?
methyl 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylate has a molecular weight of 264.31 g/mol, XLogP of 1.15, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1,3-thiazole-4-carboxylate is sourced from PubChem (CID 113307120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).