6-(4-methyl-2-pyrimidin-5-yl-1,3-thiazol-5-yl)-4-pyridin-2-ylfuro[3,2-c]pyridine

C20H13N5OS — CID 123255086

IUPAC6-(4-methyl-2-pyrimidin-5-yl-1,3-thiazol-5-yl)-4-pyridin-2-ylfuro[3,2-c]pyridine
SMILESCc1nc(-c2cncnc2)sc1-c1cc2occc2c(-c2ccccn2)n1
InChIInChI=1S/C20H13N5OS/c1-12-19(27-20(24-12)13-9-21-11-22-10-13)16-8-17-14(5-7-26-17)18(25-16)15-4-2-3-6-23-15/h2-11H,1H3
InChIKeyARDOJOYKRUUHFV-UHFFFAOYSA-N
MW371.43 g/mol
LogP4.78
Rot. Bonds3

About 6-(4-methyl-2-pyrimidin-5-yl-1,3-thiazol-5-yl)-4-pyridin-2-ylfuro[3,2-c]pyridine

6-(4-methyl-2-pyrimidin-5-yl-1,3-thiazol-5-yl)-4-pyridin-2-ylfuro[3,2-c]pyridine (PubChem CID 123255086) has the molecular formula C20H13N5OS and a molecular weight of 371.43 g/mol. Its IUPAC name is 6-(4-methyl-2-pyrimidin-5-yl-1,3-thiazol-5-yl)-4-pyridin-2-ylfuro[3,2-c]pyridine.

Molecular Properties

Compound Name6-(4-methyl-2-pyrimidin-5-yl-1,3-thiazol-5-yl)-4-pyridin-2-ylfuro[3,2-c]pyridine
PubChem CID123255086
Molecular FormulaC20H13N5OS
Molecular Weight371.43 g/mol
Exact Mass371.08
IUPAC Name6-(4-methyl-2-pyrimidin-5-yl-1,3-thiazol-5-yl)-4-pyridin-2-ylfuro[3,2-c]pyridine
SMILESCc1nc(-c2cncnc2)sc1-c1cc2occc2c(-c2ccccn2)n1
InChIInChI=1S/C20H13N5OS/c1-12-19(27-20(24-12)13-9-21-11-22-10-13)16-8-17-14(5-7-26-17)18(25-16)15-4-2-3-6-23-15/h2-11H,1H3
InChIKeyARDOJOYKRUUHFV-UHFFFAOYSA-N
XLogP4.78
TPSA77.59 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.43
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(4-methyl-2-pyrimidin-5-yl-1,3-thiazol-5-yl)-4-pyridin-2-ylfuro[3,2-c]pyridine?
The IUPAC name of 6-(4-methyl-2-pyrimidin-5-yl-1,3-thiazol-5-yl)-4-pyridin-2-ylfuro[3,2-c]pyridine (CID 123255086) is 6-(4-methyl-2-pyrimidin-5-yl-1,3-thiazol-5-yl)-4-pyridin-2-ylfuro[3,2-c]pyridine.
What is the SMILES notation for 6-(4-methyl-2-pyrimidin-5-yl-1,3-thiazol-5-yl)-4-pyridin-2-ylfuro[3,2-c]pyridine?
The canonical SMILES for 6-(4-methyl-2-pyrimidin-5-yl-1,3-thiazol-5-yl)-4-pyridin-2-ylfuro[3,2-c]pyridine is Cc1nc(-c2cncnc2)sc1-c1cc2occc2c(-c2ccccn2)n1.
What is the InChIKey of 6-(4-methyl-2-pyrimidin-5-yl-1,3-thiazol-5-yl)-4-pyridin-2-ylfuro[3,2-c]pyridine?
The InChIKey is ARDOJOYKRUUHFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13N5OS/c1-12-19(27-20(24-12)13-9-21-11-22-10-13)16-8-17-14(5-7-26-17)18(25-16)15-4-2-3-6-23-15/h2-11H,1H3.
What are the key properties of 6-(4-methyl-2-pyrimidin-5-yl-1,3-thiazol-5-yl)-4-pyridin-2-ylfuro[3,2-c]pyridine?
6-(4-methyl-2-pyrimidin-5-yl-1,3-thiazol-5-yl)-4-pyridin-2-ylfuro[3,2-c]pyridine has a molecular weight of 371.43 g/mol, XLogP of 4.78, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methyl-2-pyrimidin-5-yl-1,3-thiazol-5-yl)-4-pyridin-2-ylfuro[3,2-c]pyridine is sourced from PubChem (CID 123255086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).