3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrochloride

C14H16BrClN2OS — CID 2843855

IUPAC3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrochloride
SMILESCCCOc1ccc(Br)cc1C1=CSC2=NCCN12.Cl
InChIInChI=1S/C14H15BrN2OS.ClH/c1-2-7-18-13-4-3-10(15)8-11(13)12-9-19-14-16-5-6-17(12)14;/h3-4,8-9H,2,5-7H2,1H3;1H
InChIKeyAXGGWHLXXHCTPZ-UHFFFAOYSA-N
MW375.72 g/mol
LogP4.38
Rot. Bonds4

About 3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrochloride

3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrochloride (PubChem CID 2843855) has the molecular formula C14H16BrClN2OS and a molecular weight of 375.72 g/mol. Its IUPAC name is 3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrochloride.

Molecular Properties

Compound Name3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrochloride
PubChem CID2843855
Molecular FormulaC14H16BrClN2OS
Molecular Weight375.72 g/mol
Exact Mass373.99
IUPAC Name3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrochloride
SMILESCCCOc1ccc(Br)cc1C1=CSC2=NCCN12.Cl
InChIInChI=1S/C14H15BrN2OS.ClH/c1-2-7-18-13-4-3-10(15)8-11(13)12-9-19-14-16-5-6-17(12)14;/h3-4,8-9H,2,5-7H2,1H3;1H
InChIKeyAXGGWHLXXHCTPZ-UHFFFAOYSA-N
XLogP4.38
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.72
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Imidazo(2,1-b)thiazole, 5,6-dihydro-3-(4-propoxyphenyl)-, monohydrochloride
CID 3076280
Phenol, 4-bromo-2-(5,6-dihydroimidazo(2,1-b)thiazol-3-yl)-, monohydrochloride
CID 3074656
3-(3-Bromo-4-methoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide
CID 23723153
3-(4-Propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 2843820
3-(3-Bromo-4-methoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 684864
4-Bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol
CID 658058
3-(5-Bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 1612034
3-(5-Bromo-2-methoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 2857481
4-Bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol chloride
CID 53314151
3-(3-Bromo-4-methoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole bromide
CID 53351549
3-(4-Propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole chloride
CID 53351603
4-Bromo-2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)phenol;hydron;chloride
CID 658057

Frequently Asked Questions

What is the IUPAC name of 3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrochloride?
The IUPAC name of 3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrochloride (CID 2843855) is 3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrochloride.
What is the SMILES notation for 3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrochloride?
The canonical SMILES for 3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrochloride is CCCOc1ccc(Br)cc1C1=CSC2=NCCN12.Cl.
What is the InChIKey of 3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrochloride?
The InChIKey is AXGGWHLXXHCTPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN2OS.ClH/c1-2-7-18-13-4-3-10(15)8-11(13)12-9-19-14-16-5-6-17(12)14;/h3-4,8-9H,2,5-7H2,1H3;1H.
What are the key properties of 3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrochloride?
3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrochloride has a molecular weight of 375.72 g/mol, XLogP of 4.38, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrochloride is sourced from PubChem (CID 2843855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).