2-[(4-methylphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole

C19H16N2S — CID 15991403

IUPAC2-[(4-methylphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole
SMILESCc1ccc(Cc2cn3cc(-c4ccccc4)nc3s2)cc1
InChIInChI=1S/C19H16N2S/c1-14-7-9-15(10-8-14)11-17-12-21-13-18(20-19(21)22-17)16-5-3-2-4-6-16/h2-10,12-13H,11H2,1H3
InChIKeyCZSKXQQWZHNXKM-UHFFFAOYSA-N
MW304.42 g/mol
LogP4.96
Rot. Bonds3

About 2-[(4-methylphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole

2-[(4-methylphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole (PubChem CID 15991403) has the molecular formula C19H16N2S and a molecular weight of 304.42 g/mol. Its IUPAC name is 2-[(4-methylphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name2-[(4-methylphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole
PubChem CID15991403
Molecular FormulaC19H16N2S
Molecular Weight304.42 g/mol
Exact Mass304.10
IUPAC Name2-[(4-methylphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole
SMILESCc1ccc(Cc2cn3cc(-c4ccccc4)nc3s2)cc1
InChIInChI=1S/C19H16N2S/c1-14-7-9-15(10-8-14)11-17-12-21-13-18(20-19(21)22-17)16-5-3-2-4-6-16/h2-10,12-13H,11H2,1H3
InChIKeyCZSKXQQWZHNXKM-UHFFFAOYSA-N
XLogP4.96
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-(4-Fluorophenyl)-2,3-dihydro-5-(4-pyridinyl)imidazo(2,1-b)thiazole
CID 5228
6-Phenyl-2,3-dihydroimidazo(2,1-b)thiazole
CID 432820
1-phenyl-2-(p-tolyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium bromide
CID 16682272
3-{Imidazo[2,1-b][1,3]thiazol-6-yl}aniline
CID 3312672
Imidazopyridine 10e
CID 5329344
Imidazopyridine 10f
CID 5329345
1-[(4-methylphenyl)methyl]-4-(thiophen-3-yl)-1H-imidazole
CID 6539905
4-(2-Thienyl)-1-(4-Methylbenzyl)-1h-Imidazole
CID 446185
Pifithrin-Beta
CID 443278
4-[6-(4-Fluorophenyl)-2-[(4-methylpiperazin-1-yl)methyl]imidazo[2,1-b][1,3]thiazol-5-yl]pyrimidin-2-amine
CID 44579300
N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide
CID 685797
2-Phenyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole
CID 760886

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methylphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 2-[(4-methylphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole (CID 15991403) is 2-[(4-methylphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 2-[(4-methylphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 2-[(4-methylphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole is Cc1ccc(Cc2cn3cc(-c4ccccc4)nc3s2)cc1.
What is the InChIKey of 2-[(4-methylphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole?
The InChIKey is CZSKXQQWZHNXKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2S/c1-14-7-9-15(10-8-14)11-17-12-21-13-18(20-19(21)22-17)16-5-3-2-4-6-16/h2-10,12-13H,11H2,1H3.
What are the key properties of 2-[(4-methylphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole?
2-[(4-methylphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole has a molecular weight of 304.42 g/mol, XLogP of 4.96, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methylphenyl)methyl]-6-phenylimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 15991403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).