2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one

C18H18N6OS — CID 156888103

IUPAC2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one
SMILESCn1cc2cc(-c3nc4c(=O)n(C5CCNCC5)cnc4s3)ccc2n1
InChIInChI=1S/C18H18N6OS/c1-23-9-12-8-11(2-3-14(12)22-23)16-21-15-17(26-16)20-10-24(18(15)25)13-4-6-19-7-5-13/h2-3,8-10,13,19H,4-7H2,1H3
InChIKeyPJBYZBOIRANMFU-UHFFFAOYSA-N
MW366.45 g/mol
LogP2.33
Rot. Bonds2

About 2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one

2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one (PubChem CID 156888103) has the molecular formula C18H18N6OS and a molecular weight of 366.45 g/mol. Its IUPAC name is 2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one.

Molecular Properties

Compound Name2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one
PubChem CID156888103
Molecular FormulaC18H18N6OS
Molecular Weight366.45 g/mol
Exact Mass366.13
IUPAC Name2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one
SMILESCn1cc2cc(-c3nc4c(=O)n(C5CCNCC5)cnc4s3)ccc2n1
InChIInChI=1S/C18H18N6OS/c1-23-9-12-8-11(2-3-14(12)22-23)16-21-15-17(26-16)20-10-24(18(15)25)13-4-6-19-7-5-13/h2-3,8-10,13,19H,4-7H2,1H3
InChIKeyPJBYZBOIRANMFU-UHFFFAOYSA-N
XLogP2.33
TPSA77.63 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.45
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one with MolForge

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

Launch Full Analysis

Related Compounds

6-(2,7-dimethylindazol-5-yl)-3-piperidin-4-ylquinazolin-4-one
CID 156888169
2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
CID 156888108
5-(2-methylindazol-5-yl)-2-piperidin-4-yl-6H-[1,3]thiazolo[5,4-d]pyrimidin-7-one
CID 156888736
4-[2-(2,7-dimethylindazol-5-yl)-7-oxo-[1,3]thiazolo[5,4-d]pyrimidin-6-yl]-2,2,6,6-tetramethylpiperidine-1-carbaldehyde
CID 156888120
2-(2,7-dimethylpyrazolo[3,4-c]pyridin-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-7-one
CID 156888845
N-methyl-6-(2-methylindazol-5-yl)-N-piperidin-4-yl-[1,3]thiazolo[4,5-b]pyridin-2-amine;hydrochloride
CID 153383564
7-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-piperidin-4-ylquinazolin-4-one
CID 156889114
2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperidin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-7-one
CID 156888741
7-(2,7-dimethylindazol-5-yl)-3-(1-methylpiperidin-4-yl)quinazolin-4-one
CID 156889025
6-(7-ethyl-2-methylindazol-5-yl)-2-piperidin-4-yl-1,3-benzothiazole
CID 151072490
5-(2-methylindazol-5-yl)-1,3-thiazol-2-amine
CID 168925568
6-(2,7-dimethylindazol-5-yl)-2-piperidin-4-yl-1,3-benzothiazole;hydrochloride
CID 153383029

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one?
The IUPAC name of 2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one (CID 156888103) is 2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one.
What is the SMILES notation for 2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one?
The canonical SMILES for 2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one is Cn1cc2cc(-c3nc4c(=O)n(C5CCNCC5)cnc4s3)ccc2n1.
What is the InChIKey of 2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one?
The InChIKey is PJBYZBOIRANMFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N6OS/c1-23-9-12-8-11(2-3-14(12)22-23)16-21-15-17(26-16)20-10-24(18(15)25)13-4-6-19-7-5-13/h2-3,8-10,13,19H,4-7H2,1H3.
What are the key properties of 2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one?
2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one has a molecular weight of 366.45 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one is sourced from PubChem (CID 156888103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).