N-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide

C18H12ClN3OS — CID 42271470

IUPACN-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1csc2nc(-c3ccccc3)cn12
InChIInChI=1S/C18H12ClN3OS/c19-13-8-4-5-9-14(13)20-17(23)16-11-24-18-21-15(10-22(16)18)12-6-2-1-3-7-12/h1-11H,(H,20,23)
InChIKeyMGWCDBOGHDVRSI-UHFFFAOYSA-N
MW353.83 g/mol
LogP4.97
Rot. Bonds3

About N-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide

N-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide (PubChem CID 42271470) has the molecular formula C18H12ClN3OS and a molecular weight of 353.83 g/mol. Its IUPAC name is N-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide
PubChem CID42271470
Molecular FormulaC18H12ClN3OS
Molecular Weight353.83 g/mol
Exact Mass353.04
IUPAC NameN-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1csc2nc(-c3ccccc3)cn12
InChIInChI=1S/C18H12ClN3OS/c19-13-8-4-5-9-14(13)20-17(23)16-11-24-18-21-15(10-22(16)18)12-6-2-1-3-7-12/h1-11H,(H,20,23)
InChIKeyMGWCDBOGHDVRSI-UHFFFAOYSA-N
XLogP4.97
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.83
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide (CID 42271470) is N-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide is O=C(Nc1ccccc1Cl)c1csc2nc(-c3ccccc3)cn12.
What is the InChIKey of N-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide?
The InChIKey is MGWCDBOGHDVRSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12ClN3OS/c19-13-8-4-5-9-14(13)20-17(23)16-11-24-18-21-15(10-22(16)18)12-6-2-1-3-7-12/h1-11H,(H,20,23).
What are the key properties of N-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide?
N-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide has a molecular weight of 353.83 g/mol, XLogP of 4.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide is sourced from PubChem (CID 42271470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).