N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide

C20H13F2N3O2S — CID 34807215

IUPACN-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
SMILESO=C(Cc1coc(-c2ccccc2)n1)Nc1nc(-c2cc(F)ccc2F)cs1
InChIInChI=1S/C20H13F2N3O2S/c21-13-6-7-16(22)15(8-13)17-11-28-20(24-17)25-18(26)9-14-10-27-19(23-14)12-4-2-1-3-5-12/h1-8,10-11H,9H2,(H,24,25,26)
InChIKeyDZWPMMUZKQLYAN-UHFFFAOYSA-N
MW397.41 g/mol
LogP4.92
Rot. Bonds5

About N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide

N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide (PubChem CID 34807215) has the molecular formula C20H13F2N3O2S and a molecular weight of 397.41 g/mol. Its IUPAC name is N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide.

Molecular Properties

Compound NameN-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
PubChem CID34807215
Molecular FormulaC20H13F2N3O2S
Molecular Weight397.41 g/mol
Exact Mass397.07
IUPAC NameN-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
SMILESO=C(Cc1coc(-c2ccccc2)n1)Nc1nc(-c2cc(F)ccc2F)cs1
InChIInChI=1S/C20H13F2N3O2S/c21-13-6-7-16(22)15(8-13)17-11-28-20(24-17)25-18(26)9-14-10-27-19(23-14)12-4-2-1-3-5-12/h1-8,10-11H,9H2,(H,24,25,26)
InChIKeyDZWPMMUZKQLYAN-UHFFFAOYSA-N
XLogP4.92
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.41
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide
CID 30847400
N-(3,5-difluorophenyl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 34169541
N-(5-fluoro-2-methylphenyl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 34803562
N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(4-methoxyphenyl)acetamide
CID 8839170
N-[5-[(3-fluorophenyl)methyl]-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 39220859
N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-methylphenoxy)acetamide
CID 8839185
N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]hexanamide
CID 26207795
2-(4-acetamidophenyl)sulfanyl-N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]acetamide
CID 34518213
N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
CID 16529731
N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)acetamide
CID 7888834
N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]butanamide
CID 38910434
N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 55900351

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide?
The IUPAC name of N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide (CID 34807215) is N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide.
What is the SMILES notation for N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide?
The canonical SMILES for N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide is O=C(Cc1coc(-c2ccccc2)n1)Nc1nc(-c2cc(F)ccc2F)cs1.
What is the InChIKey of N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide?
The InChIKey is DZWPMMUZKQLYAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13F2N3O2S/c21-13-6-7-16(22)15(8-13)17-11-28-20(24-17)25-18(26)9-14-10-27-19(23-14)12-4-2-1-3-5-12/h1-8,10-11H,9H2,(H,24,25,26).
What are the key properties of N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide?
N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide has a molecular weight of 397.41 g/mol, XLogP of 4.92, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide is sourced from PubChem (CID 34807215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).