7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one

C19H19FN6OS — CID 156888579

IUPAC7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESCc1cn2cc(-c3cc(=O)n4cc(N5CCN(C)CC5)sc4n3)cc(F)c2n1
InChIInChI=1S/C19H19FN6OS/c1-12-9-25-10-13(7-14(20)18(25)21-12)15-8-16(27)26-11-17(28-19(26)22-15)24-5-3-23(2)4-6-24/h7-11H,3-6H2,1-2H3
InChIKeyKMVHDJVHGWOQHV-UHFFFAOYSA-N
MW398.47 g/mol
LogP2.27
Rot. Bonds2

About 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one

7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one (PubChem CID 156888579) has the molecular formula C19H19FN6OS and a molecular weight of 398.47 g/mol. Its IUPAC name is 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
PubChem CID156888579
Molecular FormulaC19H19FN6OS
Molecular Weight398.47 g/mol
Exact Mass398.13
IUPAC Name7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESCc1cn2cc(-c3cc(=O)n4cc(N5CCN(C)CC5)sc4n3)cc(F)c2n1
InChIInChI=1S/C19H19FN6OS/c1-12-9-25-10-13(7-14(20)18(25)21-12)15-8-16(27)26-11-17(28-19(26)22-15)24-5-3-23(2)4-6-24/h7-11H,3-6H2,1-2H3
InChIKeyKMVHDJVHGWOQHV-UHFFFAOYSA-N
XLogP2.27
TPSA58.15 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.47
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The IUPAC name of 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one (CID 156888579) is 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one.
What is the SMILES notation for 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The canonical SMILES for 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one is Cc1cn2cc(-c3cc(=O)n4cc(N5CCN(C)CC5)sc4n3)cc(F)c2n1.
What is the InChIKey of 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The InChIKey is KMVHDJVHGWOQHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN6OS/c1-12-9-25-10-13(7-14(20)18(25)21-12)15-8-16(27)26-11-17(28-19(26)22-15)24-5-3-23(2)4-6-24/h7-11H,3-6H2,1-2H3.
What are the key properties of 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one has a molecular weight of 398.47 g/mol, XLogP of 2.27, 2 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-methylpiperazin-1-yl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one is sourced from PubChem (CID 156888579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).