[6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine

C20H19N3O2S — CID 82367621

IUPAC[6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
SMILESCOc1ccc(-c2nc3sc(-c4ccccc4)cn3c2CN)cc1OC
InChIInChI=1S/C20H19N3O2S/c1-24-16-9-8-14(10-17(16)25-2)19-15(11-21)23-12-18(26-20(23)22-19)13-6-4-3-5-7-13/h3-10,12H,11,21H2,1-2H3
InChIKeyLSSVYNNVUFTCHG-UHFFFAOYSA-N
MW365.46 g/mol
LogP4.21
Rot. Bonds5

About [6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine

[6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine (PubChem CID 82367621) has the molecular formula C20H19N3O2S and a molecular weight of 365.46 g/mol. Its IUPAC name is [6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine.

Molecular Properties

Compound Name[6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
PubChem CID82367621
Molecular FormulaC20H19N3O2S
Molecular Weight365.46 g/mol
Exact Mass365.12
IUPAC Name[6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
SMILESCOc1ccc(-c2nc3sc(-c4ccccc4)cn3c2CN)cc1OC
InChIInChI=1S/C20H19N3O2S/c1-24-16-9-8-14(10-17(16)25-2)19-15(11-21)23-12-18(26-20(23)22-19)13-6-4-3-5-7-13/h3-10,12H,11,21H2,1-2H3
InChIKeyLSSVYNNVUFTCHG-UHFFFAOYSA-N
XLogP4.21
TPSA61.78 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.46
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 82367681
[6-[4-(4-methoxyphenyl)phenyl]-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 82367642
[6-(4-ethylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 82367601
[6-(4-tert-butylphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 82367613
[6-(4-chlorophenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 82367605
[6-chloro-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 39199396
[2-(3,4-dimethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine
CID 82060633
6-(3,4-dimethoxyphenyl)-3,5-diethylimidazo[2,1-b][1,3]thiazole-2-carboxylic acid
CID 82035683
4-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-1,3-thiazole
CID 70800600
6-(3,4-dimethoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole-2-carboxylic acid
CID 82035666
[2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyrimidin-3-yl]methanamine
CID 95474904
6-(3,4-dimethoxyphenyl)-3-methylimidazo[2,1-b][1,3]thiazole-2-carboxylic acid
CID 92914193

Frequently Asked Questions

What is the IUPAC name of [6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
The IUPAC name of [6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine (CID 82367621) is [6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine.
What is the SMILES notation for [6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
The canonical SMILES for [6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine is COc1ccc(-c2nc3sc(-c4ccccc4)cn3c2CN)cc1OC.
What is the InChIKey of [6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
The InChIKey is LSSVYNNVUFTCHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2S/c1-24-16-9-8-14(10-17(16)25-2)19-15(11-21)23-12-18(26-20(23)22-19)13-6-4-3-5-7-13/h3-10,12H,11,21H2,1-2H3.
What are the key properties of [6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
[6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine has a molecular weight of 365.46 g/mol, XLogP of 4.21, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3,4-dimethoxyphenyl)-2-phenylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine is sourced from PubChem (CID 82367621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).