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

C18H19FN2OS — CID 150923093

IUPACcyclohexyl-[2-(2-fluorophenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol
SMILESOC(c1c(-c2ccccc2F)sc2cncn12)C1CCCCC1
InChIInChI=1S/C18H19FN2OS/c19-14-9-5-4-8-13(14)18-16(21-11-20-10-15(21)23-18)17(22)12-6-2-1-3-7-12/h4-5,8-12,17,22H,1-3,6-7H2
InChIKeyLELFIJQGYOINJQ-UHFFFAOYSA-N
MW330.43 g/mol
LogP4.82
Rot. Bonds3

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

cyclohexyl-[2-(2-fluorophenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol (PubChem CID 150923093) has the molecular formula C18H19FN2OS and a molecular weight of 330.43 g/mol. Its IUPAC name is cyclohexyl-[2-(2-fluorophenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol.

Molecular Properties

Compound Namecyclohexyl-[2-(2-fluorophenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol
PubChem CID150923093
Molecular FormulaC18H19FN2OS
Molecular Weight330.43 g/mol
Exact Mass330.12
IUPAC Namecyclohexyl-[2-(2-fluorophenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol
SMILESOC(c1c(-c2ccccc2F)sc2cncn12)C1CCCCC1
InChIInChI=1S/C18H19FN2OS/c19-14-9-5-4-8-13(14)18-16(21-11-20-10-15(21)23-18)17(22)12-6-2-1-3-7-12/h4-5,8-12,17,22H,1-3,6-7H2
InChIKeyLELFIJQGYOINJQ-UHFFFAOYSA-N
XLogP4.82
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl-[2-(2-fluorophenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol?
The IUPAC name of cyclohexyl-[2-(2-fluorophenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol (CID 150923093) is cyclohexyl-[2-(2-fluorophenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol.
What is the SMILES notation for cyclohexyl-[2-(2-fluorophenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol?
The canonical SMILES for cyclohexyl-[2-(2-fluorophenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol is OC(c1c(-c2ccccc2F)sc2cncn12)C1CCCCC1.
What is the InChIKey of cyclohexyl-[2-(2-fluorophenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol?
The InChIKey is LELFIJQGYOINJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2OS/c19-14-9-5-4-8-13(14)18-16(21-11-20-10-15(21)23-18)17(22)12-6-2-1-3-7-12/h4-5,8-12,17,22H,1-3,6-7H2.
What are the key properties of cyclohexyl-[2-(2-fluorophenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol?
cyclohexyl-[2-(2-fluorophenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol has a molecular weight of 330.43 g/mol, XLogP of 4.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-[2-(2-fluorophenyl)imidazo[5,1-b][1,3]thiazol-3-yl]methanol is sourced from PubChem (CID 150923093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).