N-(4-phenyl-1,3-thiazol-2-yl)-2-(4-pyridin-4-ylphenyl)acetamide

C22H17N3OS — CID 58447763

IUPACN-(4-phenyl-1,3-thiazol-2-yl)-2-(4-pyridin-4-ylphenyl)acetamide
SMILESO=C(Cc1ccc(-c2ccncc2)cc1)Nc1nc(-c2ccccc2)cs1
InChIInChI=1S/C22H17N3OS/c26-21(25-22-24-20(15-27-22)19-4-2-1-3-5-19)14-16-6-8-17(9-7-16)18-10-12-23-13-11-18/h1-13,15H,14H2,(H,24,25,26)
InChIKeyYLXBWBPZHOOGOX-UHFFFAOYSA-N
MW371.47 g/mol
LogP5.05
Rot. Bonds5

About N-(4-phenyl-1,3-thiazol-2-yl)-2-(4-pyridin-4-ylphenyl)acetamide

N-(4-phenyl-1,3-thiazol-2-yl)-2-(4-pyridin-4-ylphenyl)acetamide (PubChem CID 58447763) has the molecular formula C22H17N3OS and a molecular weight of 371.47 g/mol. Its IUPAC name is N-(4-phenyl-1,3-thiazol-2-yl)-2-(4-pyridin-4-ylphenyl)acetamide.

Molecular Properties

Compound NameN-(4-phenyl-1,3-thiazol-2-yl)-2-(4-pyridin-4-ylphenyl)acetamide
PubChem CID58447763
Molecular FormulaC22H17N3OS
Molecular Weight371.47 g/mol
Exact Mass371.11
IUPAC NameN-(4-phenyl-1,3-thiazol-2-yl)-2-(4-pyridin-4-ylphenyl)acetamide
SMILESO=C(Cc1ccc(-c2ccncc2)cc1)Nc1nc(-c2ccccc2)cs1
InChIInChI=1S/C22H17N3OS/c26-21(25-22-24-20(15-27-22)19-4-2-1-3-5-19)14-16-6-8-17(9-7-16)18-10-12-23-13-11-18/h1-13,15H,14H2,(H,24,25,26)
InChIKeyYLXBWBPZHOOGOX-UHFFFAOYSA-N
XLogP5.05
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.47
LogP ≤ 55.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Masitinib
CID 10074640
N-(5-(Aminosulfonyl)-4-methyl-1,3-thiazol-2-yl)-N-methyl-2-(4-(2-pyridinyl)phenyl)acetamide
CID 491941
Tak-715
CID 9952773
3-Pyridinecarboxamide, N-(4-phenyl-2-thiazolyl)-
CID 203433
N-[4-(3,5-dimethylphenyl)-5-(4-pyridyl)-1,3-thiazol-2-yl]nicotinamide
CID 22282339
N-(5-Isopropyl-thiazol-2-YL)-2-pyridin-3-YL-acetamide
CID 5327096
N-(4-phenyl-1,3-thiazol-2-yl)pyridine-4-carboxamide
CID 790259
(4-Phenyl-thiazol-2-yl)-pyridin-2-yl-amine
CID 750531
Acetamide, N-[4-[2-(2-pyridinylamino)-4-thiazolyl]phenyl]-
CID 973066
N-(2-ethylphenyl)-4-(pyridin-3-yl)-1,3-thiazol-2-amine
CID 746667
N-(4-Pyridin-2-yl-thiazol-2-yl)-benzamide
CID 4119262
N-(4-ethyl-5-sulfamoyl-1,3-thiazol-2-yl)-N-methyl-2-(4-pyridin-2-ylphenyl)acetamide
CID 123372490

Frequently Asked Questions

What is the IUPAC name of N-(4-phenyl-1,3-thiazol-2-yl)-2-(4-pyridin-4-ylphenyl)acetamide?
The IUPAC name of N-(4-phenyl-1,3-thiazol-2-yl)-2-(4-pyridin-4-ylphenyl)acetamide (CID 58447763) is N-(4-phenyl-1,3-thiazol-2-yl)-2-(4-pyridin-4-ylphenyl)acetamide.
What is the SMILES notation for N-(4-phenyl-1,3-thiazol-2-yl)-2-(4-pyridin-4-ylphenyl)acetamide?
The canonical SMILES for N-(4-phenyl-1,3-thiazol-2-yl)-2-(4-pyridin-4-ylphenyl)acetamide is O=C(Cc1ccc(-c2ccncc2)cc1)Nc1nc(-c2ccccc2)cs1.
What is the InChIKey of N-(4-phenyl-1,3-thiazol-2-yl)-2-(4-pyridin-4-ylphenyl)acetamide?
The InChIKey is YLXBWBPZHOOGOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N3OS/c26-21(25-22-24-20(15-27-22)19-4-2-1-3-5-19)14-16-6-8-17(9-7-16)18-10-12-23-13-11-18/h1-13,15H,14H2,(H,24,25,26).
What are the key properties of N-(4-phenyl-1,3-thiazol-2-yl)-2-(4-pyridin-4-ylphenyl)acetamide?
N-(4-phenyl-1,3-thiazol-2-yl)-2-(4-pyridin-4-ylphenyl)acetamide has a molecular weight of 371.47 g/mol, XLogP of 5.05, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenyl-1,3-thiazol-2-yl)-2-(4-pyridin-4-ylphenyl)acetamide is sourced from PubChem (CID 58447763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).