cyclohexyl-[2-(4-methoxyphenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol

C19H22N2O2S — CID 150597574

IUPACcyclohexyl-[2-(4-methoxyphenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol
SMILESCOc1ccc(-c2sc3cncn3c2C(O)C2CCCCC2)cc1
InChIInChI=1S/C19H22N2O2S/c1-23-15-9-7-14(8-10-15)19-17(21-12-20-11-16(21)24-19)18(22)13-5-3-2-4-6-13/h7-13,18,22H,2-6H2,1H3
InChIKeyIREFYNIMWTZTOA-UHFFFAOYSA-N
MW342.46 g/mol
LogP4.69
Rot. Bonds4

About cyclohexyl-[2-(4-methoxyphenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol

cyclohexyl-[2-(4-methoxyphenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol (PubChem CID 150597574) has the molecular formula C19H22N2O2S and a molecular weight of 342.46 g/mol. Its IUPAC name is cyclohexyl-[2-(4-methoxyphenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol.

Molecular Properties

Compound Namecyclohexyl-[2-(4-methoxyphenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol
PubChem CID150597574
Molecular FormulaC19H22N2O2S
Molecular Weight342.46 g/mol
Exact Mass342.14
IUPAC Namecyclohexyl-[2-(4-methoxyphenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol
SMILESCOc1ccc(-c2sc3cncn3c2C(O)C2CCCCC2)cc1
InChIInChI=1S/C19H22N2O2S/c1-23-15-9-7-14(8-10-15)19-17(21-12-20-11-16(21)24-19)18(22)13-5-3-2-4-6-13/h7-13,18,22H,2-6H2,1H3
InChIKeyIREFYNIMWTZTOA-UHFFFAOYSA-N
XLogP4.69
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.46
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl-[2-(4-methoxyphenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol?
The IUPAC name of cyclohexyl-[2-(4-methoxyphenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol (CID 150597574) is cyclohexyl-[2-(4-methoxyphenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol.
What is the SMILES notation for cyclohexyl-[2-(4-methoxyphenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol?
The canonical SMILES for cyclohexyl-[2-(4-methoxyphenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol is COc1ccc(-c2sc3cncn3c2C(O)C2CCCCC2)cc1.
What is the InChIKey of cyclohexyl-[2-(4-methoxyphenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol?
The InChIKey is IREFYNIMWTZTOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2S/c1-23-15-9-7-14(8-10-15)19-17(21-12-20-11-16(21)24-19)18(22)13-5-3-2-4-6-13/h7-13,18,22H,2-6H2,1H3.
What are the key properties of cyclohexyl-[2-(4-methoxyphenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol?
cyclohexyl-[2-(4-methoxyphenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol has a molecular weight of 342.46 g/mol, XLogP of 4.69, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-[2-(4-methoxyphenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol is sourced from PubChem (CID 150597574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).