3-chloro-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrazin-2-one

C10H7ClN4OS — CID 114561657

IUPAC3-chloro-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrazin-2-one
SMILESO=c1c(Cl)nccn1Cc1cn2ccsc2n1
InChIInChI=1S/C10H7ClN4OS/c11-8-9(16)14(2-1-12-8)5-7-6-15-3-4-17-10(15)13-7/h1-4,6H,5H2
InChIKeyDNBSNAVPAOYJBN-UHFFFAOYSA-N
MW266.71 g/mol
LogP1.65
Rot. Bonds2

About 3-chloro-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrazin-2-one

3-chloro-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrazin-2-one (PubChem CID 114561657) has the molecular formula C10H7ClN4OS and a molecular weight of 266.71 g/mol. Its IUPAC name is 3-chloro-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrazin-2-one.

Molecular Properties

Compound Name3-chloro-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrazin-2-one
PubChem CID114561657
Molecular FormulaC10H7ClN4OS
Molecular Weight266.71 g/mol
Exact Mass266.00
IUPAC Name3-chloro-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrazin-2-one
SMILESO=c1c(Cl)nccn1Cc1cn2ccsc2n1
InChIInChI=1S/C10H7ClN4OS/c11-8-9(16)14(2-1-12-8)5-7-6-15-3-4-17-10(15)13-7/h1-4,6H,5H2
InChIKeyDNBSNAVPAOYJBN-UHFFFAOYSA-N
XLogP1.65
TPSA52.19 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.71
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

6-[(2-methylimidazol-1-yl)methyl]imidazo[2,1-b][1,3]thiazole
CID 78918699
5-bromo-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyridin-2-one
CID 78942968
5-amino-3-bromo-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-methylpyridin-2-one
CID 104505797
6-(chloromethyl)imidazo[2,1-b][1,3]thiazole
CID 18804066
6-(chloromethyl)imidazo[2,1-b][1,3]thiazole;hydrochloride
CID 76851866
3-chloro-1-[(1-methyltriazol-4-yl)methyl]pyrazin-2-one
CID 107052060
6-[(2,3,4-trimethylpyrrol-1-yl)methyl]imidazo[2,1-b][1,3]thiazole
CID 115334565
3-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-5-iodo-2-methylpyrimidin-4-one
CID 113289281
imidazo[2,1-b][1,3]thiazol-6-ylmethylazanium
CID 7062758
1-(3,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanone
CID 115791953
9-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)purin-6-amine
CID 115334201
trifluoro(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)boranuide
CID 115334554

Frequently Asked Questions

What is the IUPAC name of 3-chloro-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrazin-2-one?
The IUPAC name of 3-chloro-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrazin-2-one (CID 114561657) is 3-chloro-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrazin-2-one.
What is the SMILES notation for 3-chloro-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrazin-2-one?
The canonical SMILES for 3-chloro-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrazin-2-one is O=c1c(Cl)nccn1Cc1cn2ccsc2n1.
What is the InChIKey of 3-chloro-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrazin-2-one?
The InChIKey is DNBSNAVPAOYJBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClN4OS/c11-8-9(16)14(2-1-12-8)5-7-6-15-3-4-17-10(15)13-7/h1-4,6H,5H2.
What are the key properties of 3-chloro-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrazin-2-one?
3-chloro-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrazin-2-one has a molecular weight of 266.71 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pyrazin-2-one is sourced from PubChem (CID 114561657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).