N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-phenylphenyl)acetamide

C26H21N3OS — CID 41427141

IUPACN-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-phenylphenyl)acetamide
SMILESCc1csc2nc(-c3cccc(NC(=O)Cc4ccc(-c5ccccc5)cc4)c3)cn12
InChIInChI=1S/C26H21N3OS/c1-18-17-31-26-28-24(16-29(18)26)22-8-5-9-23(15-22)27-25(30)14-19-10-12-21(13-11-19)20-6-3-2-4-7-20/h2-13,15-17H,14H2,1H3,(H,27,30)
InChIKeyBWIDEAIVMZWAET-UHFFFAOYSA-N
MW423.54 g/mol
LogP6.22
Rot. Bonds5

About N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-phenylphenyl)acetamide

N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-phenylphenyl)acetamide (PubChem CID 41427141) has the molecular formula C26H21N3OS and a molecular weight of 423.54 g/mol. Its IUPAC name is N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-phenylphenyl)acetamide.

Molecular Properties

Compound NameN-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-phenylphenyl)acetamide
PubChem CID41427141
Molecular FormulaC26H21N3OS
Molecular Weight423.54 g/mol
Exact Mass423.14
IUPAC NameN-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-phenylphenyl)acetamide
SMILESCc1csc2nc(-c3cccc(NC(=O)Cc4ccc(-c5ccccc5)cc4)c3)cn12
InChIInChI=1S/C26H21N3OS/c1-18-17-31-26-28-24(16-29(18)26)22-8-5-9-23(15-22)27-25(30)14-19-10-12-21(13-11-19)20-6-3-2-4-7-20/h2-13,15-17H,14H2,1H3,(H,27,30)
InChIKeyBWIDEAIVMZWAET-UHFFFAOYSA-N
XLogP6.22
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500423.54
LogP ≤ 56.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide
CID 7151265
N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide
CID 43936475
N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pentanamide
CID 7151267
N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]naphthalene-1-carboxamide
CID 40691824
N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-phenylbutanamide
CID 43936471
N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]cyclopropanecarboxamide
CID 18562185
N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]ethanesulfonamide
CID 7151320
3-chloro-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]benzamide
CID 40506297
N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propane-1-sulfonamide
CID 7151322
N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-1,3-benzodioxole-5-carboxamide
CID 7151281
6-chloro-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-carboxamide
CID 7151276
2-ethoxy-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]naphthalene-1-carboxamide
CID 41427114

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-phenylphenyl)acetamide?
The IUPAC name of N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-phenylphenyl)acetamide (CID 41427141) is N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-phenylphenyl)acetamide.
What is the SMILES notation for N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-phenylphenyl)acetamide?
The canonical SMILES for N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-phenylphenyl)acetamide is Cc1csc2nc(-c3cccc(NC(=O)Cc4ccc(-c5ccccc5)cc4)c3)cn12.
What is the InChIKey of N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-phenylphenyl)acetamide?
The InChIKey is BWIDEAIVMZWAET-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H21N3OS/c1-18-17-31-26-28-24(16-29(18)26)22-8-5-9-23(15-22)27-25(30)14-19-10-12-21(13-11-19)20-6-3-2-4-7-20/h2-13,15-17H,14H2,1H3,(H,27,30).
What are the key properties of N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-phenylphenyl)acetamide?
N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-phenylphenyl)acetamide has a molecular weight of 423.54 g/mol, XLogP of 6.22, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]-2-(4-phenylphenyl)acetamide is sourced from PubChem (CID 41427141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).