6-(furan-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one

C11H8N2O2S — CID 53486646

IUPAC6-(furan-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESO=c1c(Cc2ccco2)cnc2sccn12
InChIInChI=1S/C11H8N2O2S/c14-10-8(6-9-2-1-4-15-9)7-12-11-13(10)3-5-16-11/h1-5,7H,6H2
InChIKeyHBNVYGZUOJXJLL-UHFFFAOYSA-N
MW232.26 g/mol
LogP1.94
Rot. Bonds2

About 6-(furan-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one

6-(furan-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one (PubChem CID 53486646) has the molecular formula C11H8N2O2S and a molecular weight of 232.26 g/mol. Its IUPAC name is 6-(furan-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name6-(furan-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
PubChem CID53486646
Molecular FormulaC11H8N2O2S
Molecular Weight232.26 g/mol
Exact Mass232.03
IUPAC Name6-(furan-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESO=c1c(Cc2ccco2)cnc2sccn12
InChIInChI=1S/C11H8N2O2S/c14-10-8(6-9-2-1-4-15-9)7-12-11-13(10)3-5-16-11/h1-5,7H,6H2
InChIKeyHBNVYGZUOJXJLL-UHFFFAOYSA-N
XLogP1.94
TPSA47.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.26
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(Furan-2-YL)ethyl]-5-oxo-5H-[1,3]thiazolo[3,2-A]pyrimidine-6-carboxamide
CID 16357189
7-({[(furan-2-yl)methyl]sulfanyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 20873933
7-({[(Furan-2-YL)methyl]sulfanyl}methyl)-2-methyl-5H-[1,3]thiazolo[3,2-A]pyrimidin-5-one
CID 46258253
N-[1-(Furan-2-YL)propan-2-YL]-3-methyl-5-oxo-5H-[1,3]thiazolo[3,2-A]pyrimidine-6-carboxamide
CID 46363969
N-[2-(furan-2-yl)ethyl]-3-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
CID 46363987
2-benzylsulfanyl-5-(furan-2-ylmethyl)-1H-pyrimidin-6-one
CID 18470355
5-(furan-2-ylmethyl)-2-(6-phenylmethoxyhexylsulfanyl)-1H-pyrimidin-6-one
CID 18470356
5-(furan-2-ylmethyl)-2-(8-phenyloctylsulfanyl)-1H-pyrimidin-6-one
CID 18470539
2-[2-(2-Furanylmethylthio)ethylamino]-5-(2-furanylmethyl)-4-pyrimidone
CID 20498751
5-(furan-2-ylmethyl)-2-[(3-iodophenyl)methylsulfanyl]-1H-pyrimidin-6-one
CID 141950907
N-(4,5-dihydro-1,3-thiazol-2-yl)-3-(furan-2-yl)propanamide
CID 8105488
(5-Oxo-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 3-(furan-2-yl)propanoate
CID 8387861

Frequently Asked Questions

What is the IUPAC name of 6-(furan-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The IUPAC name of 6-(furan-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one (CID 53486646) is 6-(furan-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one.
What is the SMILES notation for 6-(furan-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The canonical SMILES for 6-(furan-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one is O=c1c(Cc2ccco2)cnc2sccn12.
What is the InChIKey of 6-(furan-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The InChIKey is HBNVYGZUOJXJLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2O2S/c14-10-8(6-9-2-1-4-15-9)7-12-11-13(10)3-5-16-11/h1-5,7H,6H2.
What are the key properties of 6-(furan-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
6-(furan-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one has a molecular weight of 232.26 g/mol, XLogP of 1.94, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one is sourced from PubChem (CID 53486646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).