4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine

C15H16N4OS2 — CID 102336956

IUPAC4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine
SMILESCc1csc(-c2nc3c(N4CCOCC4)nc(C)nc3s2)c1
InChIInChI=1S/C15H16N4OS2/c1-9-7-11(21-8-9)14-18-12-13(19-3-5-20-6-4-19)16-10(2)17-15(12)22-14/h7-8H,3-6H2,1-2H3
InChIKeyCSTWJRUHQBEVMF-UHFFFAOYSA-N
MW332.45 g/mol
LogP3.27
Rot. Bonds2

About 4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine

4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine (PubChem CID 102336956) has the molecular formula C15H16N4OS2 and a molecular weight of 332.45 g/mol. Its IUPAC name is 4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine.

Molecular Properties

Compound Name4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine
PubChem CID102336956
Molecular FormulaC15H16N4OS2
Molecular Weight332.45 g/mol
Exact Mass332.08
IUPAC Name4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine
SMILESCc1csc(-c2nc3c(N4CCOCC4)nc(C)nc3s2)c1
InChIInChI=1S/C15H16N4OS2/c1-9-7-11(21-8-9)14-18-12-13(19-3-5-20-6-4-19)16-10(2)17-15(12)22-14/h7-8H,3-6H2,1-2H3
InChIKeyCSTWJRUHQBEVMF-UHFFFAOYSA-N
XLogP3.27
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine with MolForge

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Related Compounds

4-(5-chloro-2-methyl-[1,3]thiazolo[5,4-d]pyrimidin-7-yl)morpholine
CID 58234939
4-[5-chloro-2-(5-methylsulfonyl-3-pyridinyl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine
CID 87306656
4-(2,5-dichloro-[1,3]thiazolo[5,4-d]pyrimidin-7-yl)morpholine
CID 25255100
4-(9-ethyl-2-methylpurin-6-yl)morpholine
CID 168920801
4-(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-yl)morpholine
CID 755725
4-(15-methyl-8-morpholin-4-yl-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-yl)morpholine
CID 166597405
[4-[2-methyl-5-(2-methylpropyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]-morpholin-4-ylmethanone
CID 55832933
4-(5,6-dichloro-2-methylpyrimidin-4-yl)morpholine
CID 134511412
CID 166164666
CID 166164666
N-[3-(5-chloro-7-morpholin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-2-yl)phenyl]acetamide
CID 86630074
4-[6-[4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 133461049
4-(5-methyl-2-morpholin-4-yl-1,3-thiazol-4-yl)morpholine
CID 59034806

Frequently Asked Questions

What is the IUPAC name of 4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine?
The IUPAC name of 4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine (CID 102336956) is 4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine.
What is the SMILES notation for 4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine?
The canonical SMILES for 4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine is Cc1csc(-c2nc3c(N4CCOCC4)nc(C)nc3s2)c1.
What is the InChIKey of 4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine?
The InChIKey is CSTWJRUHQBEVMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4OS2/c1-9-7-11(21-8-9)14-18-12-13(19-3-5-20-6-4-19)16-10(2)17-15(12)22-14/h7-8H,3-6H2,1-2H3.
What are the key properties of 4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine?
4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine has a molecular weight of 332.45 g/mol, XLogP of 3.27, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-methyl-2-(4-methylthiophen-2-yl)-[1,3]thiazolo[5,4-d]pyrimidin-7-yl]morpholine is sourced from PubChem (CID 102336956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).