N-(4-acetamidophenyl)-2-phenoxy-1,3-thiazole-4-carboxamide

C18H15N3O3S — CID 117092780

IUPACN-(4-acetamidophenyl)-2-phenoxy-1,3-thiazole-4-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2csc(Oc3ccccc3)n2)cc1
InChIInChI=1S/C18H15N3O3S/c1-12(22)19-13-7-9-14(10-8-13)20-17(23)16-11-25-18(21-16)24-15-5-3-2-4-6-15/h2-11H,1H3,(H,19,22)(H,20,23)
InChIKeyQUUGXLOEUMIQIF-UHFFFAOYSA-N
MW353.40 g/mol
LogP4.15
Rot. Bonds5

About N-(4-acetamidophenyl)-2-phenoxy-1,3-thiazole-4-carboxamide

N-(4-acetamidophenyl)-2-phenoxy-1,3-thiazole-4-carboxamide (PubChem CID 117092780) has the molecular formula C18H15N3O3S and a molecular weight of 353.40 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-phenoxy-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-phenoxy-1,3-thiazole-4-carboxamide
PubChem CID117092780
Molecular FormulaC18H15N3O3S
Molecular Weight353.40 g/mol
Exact Mass353.08
IUPAC NameN-(4-acetamidophenyl)-2-phenoxy-1,3-thiazole-4-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2csc(Oc3ccccc3)n2)cc1
InChIInChI=1S/C18H15N3O3S/c1-12(22)19-13-7-9-14(10-8-13)20-17(23)16-11-25-18(21-16)24-15-5-3-2-4-6-15/h2-11H,1H3,(H,19,22)(H,20,23)
InChIKeyQUUGXLOEUMIQIF-UHFFFAOYSA-N
XLogP4.15
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.40
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-phenoxy-1,3-thiazole-4-carboxylate
CID 69084587
N-(4-phenoxyphenyl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 117094559
2-benzamido-N-(4-phenoxyphenyl)-1,3-thiazole-4-carboxamide
CID 16914969
phenoxybenzene;N-phenylacetamide
CID 174350344
N-(4-acetamidophenyl)-4-phenoxybenzamide
CID 16651566
2-(benzenesulfonamido)-N-(4-phenoxyphenyl)-1,3-thiazole-4-carboxamide
CID 25405382
6-(4-acetamidophenoxy)-N-phenylpyridazine-3-carboxamide
CID 133313253
N-(4-acetamidophenyl)-2-pyridin-2-yl-1,3-thiazole-4-carboxamide
CID 48845320
N-(4-methoxyphenyl)-2-(phenylcarbamoylamino)-1,3-thiazole-4-carboxamide
CID 16948201
N-(4-acetamidophenyl)-3-phenoxybenzamide
CID 2483771
N-(4-acetamidophenyl)-2-(3-chlorophenyl)-1,3-thiazole-4-carboxamide
CID 46479944
3-acetamido-N-(4-phenoxyphenyl)benzamide
CID 24639214

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-phenoxy-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(4-acetamidophenyl)-2-phenoxy-1,3-thiazole-4-carboxamide (CID 117092780) is N-(4-acetamidophenyl)-2-phenoxy-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-phenoxy-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-phenoxy-1,3-thiazole-4-carboxamide is CC(=O)Nc1ccc(NC(=O)c2csc(Oc3ccccc3)n2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-phenoxy-1,3-thiazole-4-carboxamide?
The InChIKey is QUUGXLOEUMIQIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O3S/c1-12(22)19-13-7-9-14(10-8-13)20-17(23)16-11-25-18(21-16)24-15-5-3-2-4-6-15/h2-11H,1H3,(H,19,22)(H,20,23).
What are the key properties of N-(4-acetamidophenyl)-2-phenoxy-1,3-thiazole-4-carboxamide?
N-(4-acetamidophenyl)-2-phenoxy-1,3-thiazole-4-carboxamide has a molecular weight of 353.40 g/mol, XLogP of 4.15, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-phenoxy-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 117092780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).