[6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol

C22H22N2OS — CID 82367673

IUPAC[6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol
SMILESCC(C)(C)c1ccc(-c2nc3sc(-c4ccccc4)cn3c2CO)cc1
InChIInChI=1S/C22H22N2OS/c1-22(2,3)17-11-9-16(10-12-17)20-18(14-25)24-13-19(26-21(24)23-20)15-7-5-4-6-8-15/h4-13,25H,14H2,1-3H3
InChIKeyWGZPWCHIBXUMAS-UHFFFAOYSA-N
MW362.50 g/mol
LogP5.52
Rot. Bonds3

About [6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol

[6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol (PubChem CID 82367673) has the molecular formula C22H22N2OS and a molecular weight of 362.50 g/mol. Its IUPAC name is [6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol.

Molecular Properties

Compound Name[6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol
PubChem CID82367673
Molecular FormulaC22H22N2OS
Molecular Weight362.50 g/mol
Exact Mass362.15
IUPAC Name[6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol
SMILESCC(C)(C)c1ccc(-c2nc3sc(-c4ccccc4)cn3c2CO)cc1
InChIInChI=1S/C22H22N2OS/c1-22(2,3)17-11-9-16(10-12-17)20-18(14-25)24-13-19(26-21(24)23-20)15-7-5-4-6-8-15/h4-13,25H,14H2,1-3H3
InChIKeyWGZPWCHIBXUMAS-UHFFFAOYSA-N
XLogP5.52
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.50
LogP ≤ 55.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 82367613
[6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 82367681
(2-chloro-6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methanol
CID 50878423
[6-(4-ethylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 82367601
[6-(4-chlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 82367605
[6-[4-(4-methoxyphenyl)phenyl]-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 82367642
[2-phenyl-6-(4-propylphenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 82367652
[6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 82367621
[2-tert-butyl-6-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-5-yl]methanol
CID 82219587
[2-tert-butyl-6-(3-methoxyphenyl)imidazo[2,1-b][1,3,4]thiadiazol-5-yl]methanol
CID 94961529
[2-bromo-4-(4-tert-butylphenyl)-1,3-thiazol-5-yl]methanol
CID 131867651
2-phenyl-[1,3]thiazolo[3,2-a]benzimidazole
CID 4694439

Frequently Asked Questions

What is the IUPAC name of [6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol?
The IUPAC name of [6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol (CID 82367673) is [6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol.
What is the SMILES notation for [6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol?
The canonical SMILES for [6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol is CC(C)(C)c1ccc(-c2nc3sc(-c4ccccc4)cn3c2CO)cc1.
What is the InChIKey of [6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol?
The InChIKey is WGZPWCHIBXUMAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2OS/c1-22(2,3)17-11-9-16(10-12-17)20-18(14-25)24-13-19(26-21(24)23-20)15-7-5-4-6-8-15/h4-13,25H,14H2,1-3H3.
What are the key properties of [6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol?
[6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol has a molecular weight of 362.50 g/mol, XLogP of 5.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol is sourced from PubChem (CID 82367673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).