N-(2,4-difluorophenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide

C19H11F2N3O4S — CID 5034931

IUPACN-(2,4-difluorophenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide
SMILESO=C(Cn1c(O)c(C2=c3ccccc3=NC2=O)sc1=O)Nc1ccc(F)cc1F
InChIInChI=1S/C19H11F2N3O4S/c20-9-5-6-13(11(21)7-9)22-14(25)8-24-18(27)16(29-19(24)28)15-10-3-1-2-4-12(10)23-17(15)26/h1-7,27H,8H2,(H,22,25)
InChIKeyLTGNGGKKYHFZJI-UHFFFAOYSA-N
MW415.38 g/mol
LogP0.89
Rot. Bonds4

About N-(2,4-difluorophenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide

N-(2,4-difluorophenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide (PubChem CID 5034931) has the molecular formula C19H11F2N3O4S and a molecular weight of 415.38 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide
PubChem CID5034931
Molecular FormulaC19H11F2N3O4S
Molecular Weight415.38 g/mol
Exact Mass415.04
IUPAC NameN-(2,4-difluorophenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide
SMILESO=C(Cn1c(O)c(C2=c3ccccc3=NC2=O)sc1=O)Nc1ccc(F)cc1F
InChIInChI=1S/C19H11F2N3O4S/c20-9-5-6-13(11(21)7-9)22-14(25)8-24-18(27)16(29-19(24)28)15-10-3-1-2-4-12(10)23-17(15)26/h1-7,27H,8H2,(H,22,25)
InChIKeyLTGNGGKKYHFZJI-UHFFFAOYSA-N
XLogP0.89
TPSA100.76 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.38
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-chloro-4-methylphenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide
CID 137140854
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CID 1096308
N-(2,4-difluorophenyl)-2-[4-hydroxy-5-[(Z)-indol-3-ylidenemethyl]-2-oxo-1,3-thiazol-3-yl]acetamide
CID 135614510
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CID 135717380
N-(2,4-difluorophenyl)-2-[5-[(7-ethylindol-3-ylidene)methyl]-4-hydroxy-2-oxo-1,3-thiazol-3-yl]acetamide
CID 4541655
N-(2,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide
CID 110688890
3-(2-ethylphenyl)-4-hydroxy-5-(2-oxoindol-3-yl)-1,3-thiazol-2-one
CID 135575309
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CID 5142642
N-(2,4-difluorophenyl)-2-[2,4-dioxo-3-(2-phenylethyl)pyrido[3,2-d]pyrimidin-1-yl]acetamide
CID 18569554
N-(2,4-difluorophenyl)-2-(2-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetamide
CID 4121399
2-(2-amino-4,5-dicyanoimidazol-1-yl)-N-(2,4-difluorophenyl)acetamide
CID 75402738
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Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide?
The IUPAC name of N-(2,4-difluorophenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide (CID 5034931) is N-(2,4-difluorophenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide?
The canonical SMILES for N-(2,4-difluorophenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide is O=C(Cn1c(O)c(C2=c3ccccc3=NC2=O)sc1=O)Nc1ccc(F)cc1F.
What is the InChIKey of N-(2,4-difluorophenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide?
The InChIKey is LTGNGGKKYHFZJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11F2N3O4S/c20-9-5-6-13(11(21)7-9)22-14(25)8-24-18(27)16(29-19(24)28)15-10-3-1-2-4-12(10)23-17(15)26/h1-7,27H,8H2,(H,22,25).
What are the key properties of N-(2,4-difluorophenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide?
N-(2,4-difluorophenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide has a molecular weight of 415.38 g/mol, XLogP of 0.89, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-2-[4-hydroxy-2-oxo-5-(2-oxoindol-3-yl)-1,3-thiazol-3-yl]acetamide is sourced from PubChem (CID 5034931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).