4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine

C18H20N6O2S — CID 58508193

IUPAC4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine
SMILESc1nc2nc(-c3ccc(N4CCOCC4)nc3)nc(N3CCOCC3)c2s1
InChIInChI=1S/C18H20N6O2S/c1-2-14(23-3-7-25-8-4-23)19-11-13(1)16-21-17-15(27-12-20-17)18(22-16)24-5-9-26-10-6-24/h1-2,11-12H,3-10H2
InChIKeyPDFCNHJSZHXRCI-UHFFFAOYSA-N
MW384.47 g/mol
LogP1.82
Rot. Bonds3

About 4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine

4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine (PubChem CID 58508193) has the molecular formula C18H20N6O2S and a molecular weight of 384.47 g/mol. Its IUPAC name is 4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine.

Molecular Properties

Compound Name4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine
PubChem CID58508193
Molecular FormulaC18H20N6O2S
Molecular Weight384.47 g/mol
Exact Mass384.14
IUPAC Name4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine
SMILESc1nc2nc(-c3ccc(N4CCOCC4)nc3)nc(N3CCOCC3)c2s1
InChIInChI=1S/C18H20N6O2S/c1-2-14(23-3-7-25-8-4-23)19-11-13(1)16-21-17-15(27-12-20-17)18(22-16)24-5-9-26-10-6-24/h1-2,11-12H,3-10H2
InChIKeyPDFCNHJSZHXRCI-UHFFFAOYSA-N
XLogP1.82
TPSA76.50 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.47
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine with MolForge

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Related Compounds

4-[5-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-2-pyridinyl]morpholine
CID 58507795
4-(5-pyridin-4-yl-2-pyridinyl)morpholine
CID 10377044
4-[5-(1H-indazol-4-yl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine
CID 46204597
4-(5-methylsulfonyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl)morpholine
CID 90706830
4-[5-[5-(4-cyclopropyl-1,3-thiazol-5-yl)-1,2,4-oxadiazol-3-yl]-2-pyridinyl]morpholine
CID 127867088
6-methyl-2-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-amine
CID 117085161
5-[7-methyl-4-morpholin-4-yl-6-(6-thiomorpholin-4-yl-3-pyridinyl)thieno[3,2-d]pyrimidin-2-yl]pyrimidin-2-amine
CID 143695009
5-(2-methyl-7-morpholin-4-yl-[1,3]thiazolo[4,5-d]pyrimidin-5-yl)pyrimidin-2-amine
CID 143782763
2-[4-[5-[2-(2-aminopyrimidin-5-yl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]-2-pyridinyl]piperazin-1-yl]ethanol
CID 59829471
4-[5-[7-(4-ethylpiperazin-1-yl)thieno[2,3-c]pyridin-5-yl]-2-pyridinyl]morpholine;hydrochloride
CID 22502727
morpholin-4-yl-[2-(6-morpholin-4-yl-3-pyridinyl)-1,3-thiazol-4-yl]methanone
CID 53145852
2-[4-morpholin-2-yl-6-(6-morpholin-4-yl-3-pyridinyl)-1,3,5-triazin-2-yl]morpholine
CID 67402294

Frequently Asked Questions

What is the IUPAC name of 4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine?
The IUPAC name of 4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine (CID 58508193) is 4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine.
What is the SMILES notation for 4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine?
The canonical SMILES for 4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine is c1nc2nc(-c3ccc(N4CCOCC4)nc3)nc(N3CCOCC3)c2s1.
What is the InChIKey of 4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine?
The InChIKey is PDFCNHJSZHXRCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O2S/c1-2-14(23-3-7-25-8-4-23)19-11-13(1)16-21-17-15(27-12-20-17)18(22-16)24-5-9-26-10-6-24/h1-2,11-12H,3-10H2.
What are the key properties of 4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine?
4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine has a molecular weight of 384.47 g/mol, XLogP of 1.82, 3 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(6-morpholin-4-yl-3-pyridinyl)-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]morpholine is sourced from PubChem (CID 58508193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).