N-(4-ethoxyphenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine

C17H16N4OS2 — CID 2877569

IUPACN-(4-ethoxyphenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine
SMILESCCOc1ccc(Nc2nc(-c3c(C)nc4sccn34)cs2)cc1
InChIInChI=1S/C17H16N4OS2/c1-3-22-13-6-4-12(5-7-13)19-16-20-14(10-24-16)15-11(2)18-17-21(15)8-9-23-17/h4-10H,3H2,1-2H3,(H,19,20)
InChIKeyGFBWFHBEQJJBIU-UHFFFAOYSA-N
MW356.48 g/mol
LogP4.97
Rot. Bonds5

About N-(4-ethoxyphenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine

N-(4-ethoxyphenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine (PubChem CID 2877569) has the molecular formula C17H16N4OS2 and a molecular weight of 356.48 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine
PubChem CID2877569
Molecular FormulaC17H16N4OS2
Molecular Weight356.48 g/mol
Exact Mass356.08
IUPAC NameN-(4-ethoxyphenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine
SMILESCCOc1ccc(Nc2nc(-c3c(C)nc4sccn34)cs2)cc1
InChIInChI=1S/C17H16N4OS2/c1-3-22-13-6-4-12(5-7-13)19-16-20-14(10-24-16)15-11(2)18-17-21(15)8-9-23-17/h4-10H,3H2,1-2H3,(H,19,20)
InChIKeyGFBWFHBEQJJBIU-UHFFFAOYSA-N
XLogP4.97
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.48
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

JK184
CID 1069686
5-[4-Ethyl-1-[3-[4-(pyrrolidin-3-ylmethoxy)phenyl]propyl]imidazol-2-yl]-4-methylthieno[3,2-b]pyrrole
CID 132138946
5-[1-[2-[4-(Azepan-4-yloxy)phenoxy]ethyl]-4-ethylimidazol-2-yl]-4-methylthieno[3,2-b]pyrrole
CID 132138949
4-Methyl-5-[4-propyl-1-[3-[4-(pyrrolidin-3-ylmethoxy)phenyl]propyl]imidazol-2-yl]thieno[3,2-b]pyrrole
CID 132138980
5-[4-Ethyl-1-[2-(4-piperidin-4-yloxyphenoxy)ethyl]imidazol-2-yl]-4-methylthieno[3,2-b]pyrrole
CID 132138987
4-Methyl-5-[1-[2-(4-piperidin-4-yloxyphenoxy)ethyl]-4-propylimidazol-2-yl]thieno[3,2-b]pyrrole
CID 132139018
5-[1-[2-[4-(Azepan-4-yloxy)phenoxy]ethyl]-4-propylimidazol-2-yl]-4-methylthieno[3,2-b]pyrrole
CID 132139050
N-[3-(1H-imidazol-1-yl)propyl]-6-methoxy-1,3-benzothiazol-2-amine
CID 6539205
N-(4-methoxyphenyl)-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine
CID 667521
4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(4-methoxyphenyl)-1,3-thiazol-2-amine
CID 2877432
N-(4-Methoxyphenyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)thiazol-2-amine hydrobromide
CID 2877597
CID 2877735
CID 2877735

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine?
The IUPAC name of N-(4-ethoxyphenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine (CID 2877569) is N-(4-ethoxyphenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-(4-ethoxyphenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine?
The canonical SMILES for N-(4-ethoxyphenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine is CCOc1ccc(Nc2nc(-c3c(C)nc4sccn34)cs2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine?
The InChIKey is GFBWFHBEQJJBIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4OS2/c1-3-22-13-6-4-12(5-7-13)19-16-20-14(10-24-16)15-11(2)18-17-21(15)8-9-23-17/h4-10H,3H2,1-2H3,(H,19,20).
What are the key properties of N-(4-ethoxyphenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine?
N-(4-ethoxyphenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine has a molecular weight of 356.48 g/mol, XLogP of 4.97, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 2877569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).