2-(6-chloro-3-methylindazol-1-yl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide

C20H19ClN4O3S — CID 11582799

IUPAC2-(6-chloro-3-methylindazol-1-yl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide
SMILESCOc1ccc(C2SCC(=O)N2NC(=O)Cn2nc(C)c3ccc(Cl)cc32)cc1
InChIInChI=1S/C20H19ClN4O3S/c1-12-16-8-5-14(21)9-17(16)24(22-12)10-18(26)23-25-19(27)11-29-20(25)13-3-6-15(28-2)7-4-13/h3-9,20H,10-11H2,1-2H3,(H,23,26)
InChIKeyACFYXGQKAVMJGK-UHFFFAOYSA-N
MW430.92 g/mol
LogP3.31
Rot. Bonds5

About 2-(6-chloro-3-methylindazol-1-yl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide

2-(6-chloro-3-methylindazol-1-yl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide (PubChem CID 11582799) has the molecular formula C20H19ClN4O3S and a molecular weight of 430.92 g/mol. Its IUPAC name is 2-(6-chloro-3-methylindazol-1-yl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide.

Molecular Properties

Compound Name2-(6-chloro-3-methylindazol-1-yl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide
PubChem CID11582799
Molecular FormulaC20H19ClN4O3S
Molecular Weight430.92 g/mol
Exact Mass430.09
IUPAC Name2-(6-chloro-3-methylindazol-1-yl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide
SMILESCOc1ccc(C2SCC(=O)N2NC(=O)Cn2nc(C)c3ccc(Cl)cc32)cc1
InChIInChI=1S/C20H19ClN4O3S/c1-12-16-8-5-14(21)9-17(16)24(22-12)10-18(26)23-25-19(27)11-29-20(25)13-3-6-15(28-2)7-4-13/h3-9,20H,10-11H2,1-2H3,(H,23,26)
InChIKeyACFYXGQKAVMJGK-UHFFFAOYSA-N
XLogP3.31
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.92
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-carbazol-9-yl-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide
CID 10812585
2-(6-chloro-3,5-dimethylindazol-1-yl)-N-[2-(4-methoxyphenyl)-5-methyl-4-oxo-1,3-thiazolidin-3-yl]acetamide
CID 11691112
N-[2-(4-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-2-(1,2,4-triazol-1-yl)acetamide
CID 11024209
2-(4-chlorophenyl)-N-[2-(4-hydroxy-3-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide
CID 25023320
2-[2-(4-chlorophenyl)benzimidazol-1-yl]-N-[4-oxo-2-(4-phenylmethoxyphenyl)-1,3-thiazolidin-3-yl]acetamide
CID 57331812
N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]-2-(5-methyl-4-nitroso-2-propan-2-ylphenoxy)acetamide
CID 10765672
N-[2-(4-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-2-phenothiazin-10-ylacetamide
CID 10671957
N-[2-(4-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]-2-(5-nitroindazol-1-yl)acetamide
CID 46932982
2-(1,3-benzoxazol-2-ylsulfanyl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide
CID 15946683
N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]-3,5-dinitrobenzamide
CID 15272755
3,5-dichloro-N-[2-(2-chloro-6-methoxyquinolin-3-yl)-4-oxo-1,3-thiazolidin-3-yl]-1-benzothiophene-2-carboxamide
CID 10929578
2-[2-(4-chlorophenyl)benzimidazol-1-yl]-N-[2-(2,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide
CID 57331816

Frequently Asked Questions

What is the IUPAC name of 2-(6-chloro-3-methylindazol-1-yl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide?
The IUPAC name of 2-(6-chloro-3-methylindazol-1-yl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide (CID 11582799) is 2-(6-chloro-3-methylindazol-1-yl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide.
What is the SMILES notation for 2-(6-chloro-3-methylindazol-1-yl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide?
The canonical SMILES for 2-(6-chloro-3-methylindazol-1-yl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide is COc1ccc(C2SCC(=O)N2NC(=O)Cn2nc(C)c3ccc(Cl)cc32)cc1.
What is the InChIKey of 2-(6-chloro-3-methylindazol-1-yl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide?
The InChIKey is ACFYXGQKAVMJGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19ClN4O3S/c1-12-16-8-5-14(21)9-17(16)24(22-12)10-18(26)23-25-19(27)11-29-20(25)13-3-6-15(28-2)7-4-13/h3-9,20H,10-11H2,1-2H3,(H,23,26).
What are the key properties of 2-(6-chloro-3-methylindazol-1-yl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide?
2-(6-chloro-3-methylindazol-1-yl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide has a molecular weight of 430.92 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloro-3-methylindazol-1-yl)-N-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide is sourced from PubChem (CID 11582799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).