3-(4-ethylsulfanylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine

C13H13N3S2 — CID 98019570

IUPAC3-(4-ethylsulfanylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine
SMILESCCSc1ccc(-c2csc3nc(N)cn23)cc1
InChIInChI=1S/C13H13N3S2/c1-2-17-10-5-3-9(4-6-10)11-8-18-13-15-12(14)7-16(11)13/h3-8H,2,14H2,1H3
InChIKeyOLYOMHWFIYJHIP-UHFFFAOYSA-N
MW275.40 g/mol
LogP3.76
Rot. Bonds3

About 3-(4-ethylsulfanylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine

3-(4-ethylsulfanylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine (PubChem CID 98019570) has the molecular formula C13H13N3S2 and a molecular weight of 275.40 g/mol. Its IUPAC name is 3-(4-ethylsulfanylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine.

Molecular Properties

Compound Name3-(4-ethylsulfanylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine
PubChem CID98019570
Molecular FormulaC13H13N3S2
Molecular Weight275.40 g/mol
Exact Mass275.06
IUPAC Name3-(4-ethylsulfanylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine
SMILESCCSc1ccc(-c2csc3nc(N)cn23)cc1
InChIInChI=1S/C13H13N3S2/c1-2-17-10-5-3-9(4-6-10)11-8-18-13-15-12(14)7-16(11)13/h3-8H,2,14H2,1H3
InChIKeyOLYOMHWFIYJHIP-UHFFFAOYSA-N
XLogP3.76
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-ethylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 82478196
3-(3-chloro-4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 82487439
3-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 82487999
4-(4-ethylsulfanylphenyl)-1,3-thiazol-2-amine
CID 3762953
3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 82479018
3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 82483165
4-[6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]aniline
CID 39079843
3-(2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 82479014
1-[2-(4-ethylsulfanylphenyl)-1,3-thiazol-4-yl]cyclobutan-1-amine
CID 106850289
[2-(4-ethylsulfanylphenyl)-1,3-thiazol-4-yl]hydrazine
CID 116892116
5-(4-ethylsulfanylphenyl)-1,2-oxazol-3-amine
CID 82472660
[3-(4-propoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanol
CID 82062007

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylsulfanylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The IUPAC name of 3-(4-ethylsulfanylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine (CID 98019570) is 3-(4-ethylsulfanylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine.
What is the SMILES notation for 3-(4-ethylsulfanylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The canonical SMILES for 3-(4-ethylsulfanylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine is CCSc1ccc(-c2csc3nc(N)cn23)cc1.
What is the InChIKey of 3-(4-ethylsulfanylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The InChIKey is OLYOMHWFIYJHIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3S2/c1-2-17-10-5-3-9(4-6-10)11-8-18-13-15-12(14)7-16(11)13/h3-8H,2,14H2,1H3.
What are the key properties of 3-(4-ethylsulfanylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine?
3-(4-ethylsulfanylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine has a molecular weight of 275.40 g/mol, XLogP of 3.76, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethylsulfanylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine is sourced from PubChem (CID 98019570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).