6-(3-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-one

C15H15N3O2S — CID 142724962

IUPAC6-(3-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-one
SMILESO=C1CSc2nc(-c3cccc(N4CCOCC4)c3)cn21
InChIInChI=1S/C15H15N3O2S/c19-14-10-21-15-16-13(9-18(14)15)11-2-1-3-12(8-11)17-4-6-20-7-5-17/h1-3,8-9H,4-7,10H2
InChIKeyMBISRVRIKGAXNN-UHFFFAOYSA-N
MW301.37 g/mol
LogP2.13
Rot. Bonds2

About 6-(3-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-one

6-(3-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-one (PubChem CID 142724962) has the molecular formula C15H15N3O2S and a molecular weight of 301.37 g/mol. Its IUPAC name is 6-(3-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-one.

Molecular Properties

Compound Name6-(3-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-one
PubChem CID142724962
Molecular FormulaC15H15N3O2S
Molecular Weight301.37 g/mol
Exact Mass301.09
IUPAC Name6-(3-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-one
SMILESO=C1CSc2nc(-c3cccc(N4CCOCC4)c3)cn21
InChIInChI=1S/C15H15N3O2S/c19-14-10-21-15-16-13(9-18(14)15)11-2-1-3-12(8-11)17-4-6-20-7-5-17/h1-3,8-9H,4-7,10H2
InChIKeyMBISRVRIKGAXNN-UHFFFAOYSA-N
XLogP2.13
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(3-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-one?
The IUPAC name of 6-(3-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-one (CID 142724962) is 6-(3-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-one.
What is the SMILES notation for 6-(3-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-one?
The canonical SMILES for 6-(3-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-one is O=C1CSc2nc(-c3cccc(N4CCOCC4)c3)cn21.
What is the InChIKey of 6-(3-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-one?
The InChIKey is MBISRVRIKGAXNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2S/c19-14-10-21-15-16-13(9-18(14)15)11-2-1-3-12(8-11)17-4-6-20-7-5-17/h1-3,8-9H,4-7,10H2.
What are the key properties of 6-(3-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-one?
6-(3-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-one has a molecular weight of 301.37 g/mol, XLogP of 2.13, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-morpholin-4-ylphenyl)imidazo[2,1-b][1,3]thiazol-3-one is sourced from PubChem (CID 142724962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).