N-[(4-fluorophenyl)methyl]-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide

C19H14FN3OS — CID 134796050

IUPACN-[(4-fluorophenyl)methyl]-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide
SMILESO=C(NCc1ccc(F)cc1)c1cn2cc(-c3ccccc3)sc2n1
InChIInChI=1S/C19H14FN3OS/c20-15-8-6-13(7-9-15)10-21-18(24)16-11-23-12-17(25-19(23)22-16)14-4-2-1-3-5-14/h1-9,11-12H,10H2,(H,21,24)
InChIKeyJUESNFZTXJGKBC-UHFFFAOYSA-N
MW351.41 g/mol
LogP4.13
Rot. Bonds4

About N-[(4-fluorophenyl)methyl]-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide

N-[(4-fluorophenyl)methyl]-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide (PubChem CID 134796050) has the molecular formula C19H14FN3OS and a molecular weight of 351.41 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide
PubChem CID134796050
Molecular FormulaC19H14FN3OS
Molecular Weight351.41 g/mol
Exact Mass351.08
IUPAC NameN-[(4-fluorophenyl)methyl]-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide
SMILESO=C(NCc1ccc(F)cc1)c1cn2cc(-c3ccccc3)sc2n1
InChIInChI=1S/C19H14FN3OS/c20-15-8-6-13(7-9-15)10-21-18(24)16-11-23-12-17(25-19(23)22-16)14-4-2-1-3-5-14/h1-9,11-12H,10H2,(H,21,24)
InChIKeyJUESNFZTXJGKBC-UHFFFAOYSA-N
XLogP4.13
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide (CID 134796050) is N-[(4-fluorophenyl)methyl]-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide is O=C(NCc1ccc(F)cc1)c1cn2cc(-c3ccccc3)sc2n1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide?
The InChIKey is JUESNFZTXJGKBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FN3OS/c20-15-8-6-13(7-9-15)10-21-18(24)16-11-23-12-17(25-19(23)22-16)14-4-2-1-3-5-14/h1-9,11-12H,10H2,(H,21,24).
What are the key properties of N-[(4-fluorophenyl)methyl]-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide?
N-[(4-fluorophenyl)methyl]-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide has a molecular weight of 351.41 g/mol, XLogP of 4.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide is sourced from PubChem (CID 134796050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).