2-(4-methoxyphenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole

C16H14N2OS — CID 14118925

IUPAC2-(4-methoxyphenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole
SMILESCOc1ccc(C2CN3C(=N2)Sc2ccccc23)cc1
InChIInChI=1S/C16H14N2OS/c1-19-12-8-6-11(7-9-12)13-10-18-14-4-2-3-5-15(14)20-16(18)17-13/h2-9,13H,10H2,1H3
InChIKeyUKGBIAQGEMDTIM-UHFFFAOYSA-N
MW282.37 g/mol
LogP3.72
Rot. Bonds2

About 2-(4-methoxyphenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole

2-(4-methoxyphenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole (PubChem CID 14118925) has the molecular formula C16H14N2OS and a molecular weight of 282.37 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole
PubChem CID14118925
Molecular FormulaC16H14N2OS
Molecular Weight282.37 g/mol
Exact Mass282.08
IUPAC Name2-(4-methoxyphenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole
SMILESCOc1ccc(C2CN3C(=N2)Sc2ccccc23)cc1
InChIInChI=1S/C16H14N2OS/c1-19-12-8-6-11(7-9-12)13-10-18-14-4-2-3-5-15(14)20-16(18)17-13/h2-9,13H,10H2,1H3
InChIKeyUKGBIAQGEMDTIM-UHFFFAOYSA-N
XLogP3.72
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[[2-(4-aminophenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazol-6-yl]oxy]acetate
CID 89066019
(2S,3R)-2-naphthalen-2-yl-3-propan-2-yl-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazole
CID 50993851
2-phenanthren-9-yl-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazole
CID 71734378
8-[(4-methoxyphenyl)methylsulfanyl]-2-phenyl-2,3,5,6,7,8-hexahydroimidazo[1,2-a]pyridine
CID 13389115
1-(4-methoxyphenyl)-1-methyl-2H-[1,2,4]triazolo[3,4-b][1,3]benzothiazole
CID 3152162
2-(4-methoxyphenyl)-3,5,6,7-tetrahydro-2H-pyrrolo[1,2-a]imidazole
CID 23310773
(6S)-6-(4-methoxyphenyl)-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;6-(4-methylphenyl)-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;(6S)-6-(4-methylphenyl)-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;4-[(6S)-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazol-6-yl]phenol
CID 159351486
(4S,5R)-2-(2,3-dihydroindol-1-yl)-6-imino-4-(4-methoxyphenyl)-4,5-dihydro-1,3-thiazine-5-carbonitrile
CID 7029771
2-(4-methoxyphenyl)-4-methyl-1,4-benzothiazin-3-one
CID 14244691
(4-methoxyphenyl)-phenothiazin-10-ylmethanone
CID 1237217
3-methoxy-10-methylphenothiazine
CID 18761115
1-(2-bromophenyl)-5-(4-methoxyphenyl)-4,5-dihydroimidazol-2-amine
CID 79500908

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole?
The IUPAC name of 2-(4-methoxyphenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole (CID 14118925) is 2-(4-methoxyphenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole.
What is the SMILES notation for 2-(4-methoxyphenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole?
The canonical SMILES for 2-(4-methoxyphenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole is COc1ccc(C2CN3C(=N2)Sc2ccccc23)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole?
The InChIKey is UKGBIAQGEMDTIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2OS/c1-19-12-8-6-11(7-9-12)13-10-18-14-4-2-3-5-15(14)20-16(18)17-13/h2-9,13H,10H2,1H3.
What are the key properties of 2-(4-methoxyphenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole?
2-(4-methoxyphenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole has a molecular weight of 282.37 g/mol, XLogP of 3.72, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-1,2-dihydroimidazo[2,1-b][1,3]benzothiazole is sourced from PubChem (CID 14118925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).