6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide

C20H17N3O3S — CID 42270822

IUPAC6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide
SMILESCOc1ccc(NC(=O)c2csc3nc(-c4cccc(OC)c4)cn23)cc1
InChIInChI=1S/C20H17N3O3S/c1-25-15-8-6-14(7-9-15)21-19(24)18-12-27-20-22-17(11-23(18)20)13-4-3-5-16(10-13)26-2/h3-12H,1-2H3,(H,21,24)
InChIKeyBFEDRZZQWFAQQD-UHFFFAOYSA-N
MW379.44 g/mol
LogP4.33
Rot. Bonds5

About 6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide

6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide (PubChem CID 42270822) has the molecular formula C20H17N3O3S and a molecular weight of 379.44 g/mol. Its IUPAC name is 6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide.

Molecular Properties

Compound Name6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide
PubChem CID42270822
Molecular FormulaC20H17N3O3S
Molecular Weight379.44 g/mol
Exact Mass379.10
IUPAC Name6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide
SMILESCOc1ccc(NC(=O)c2csc3nc(-c4cccc(OC)c4)cn23)cc1
InChIInChI=1S/C20H17N3O3S/c1-25-15-8-6-14(7-9-15)21-19(24)18-12-27-20-22-17(11-23(18)20)13-4-3-5-16(10-13)26-2/h3-12H,1-2H3,(H,21,24)
InChIKeyBFEDRZZQWFAQQD-UHFFFAOYSA-N
XLogP4.33
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.44
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide?
The IUPAC name of 6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide (CID 42270822) is 6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide.
What is the SMILES notation for 6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide?
The canonical SMILES for 6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide is COc1ccc(NC(=O)c2csc3nc(-c4cccc(OC)c4)cn23)cc1.
What is the InChIKey of 6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide?
The InChIKey is BFEDRZZQWFAQQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O3S/c1-25-15-8-6-14(7-9-15)21-19(24)18-12-27-20-22-17(11-23(18)20)13-4-3-5-16(10-13)26-2/h3-12H,1-2H3,(H,21,24).
What are the key properties of 6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide?
6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide has a molecular weight of 379.44 g/mol, XLogP of 4.33, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methoxyphenyl)-N-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxamide is sourced from PubChem (CID 42270822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).