N-(6-hydroxy-1H-indazol-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide

C15H11N5O3S — CID 154798795

IUPACN-(6-hydroxy-1H-indazol-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
SMILESO=C(Cn1cnc2sccc2c1=O)Nc1n[nH]c2cc(O)ccc12
InChIInChI=1S/C15H11N5O3S/c21-8-1-2-9-11(5-8)18-19-13(9)17-12(22)6-20-7-16-14-10(15(20)23)3-4-24-14/h1-5,7,21H,6H2,(H2,17,18,19,22)
InChIKeyOFCGGPYXJURNQS-UHFFFAOYSA-N
MW341.35 g/mol
LogP1.68
Rot. Bonds3

About N-(6-hydroxy-1H-indazol-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide

N-(6-hydroxy-1H-indazol-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide (PubChem CID 154798795) has the molecular formula C15H11N5O3S and a molecular weight of 341.35 g/mol. Its IUPAC name is N-(6-hydroxy-1H-indazol-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(6-hydroxy-1H-indazol-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
PubChem CID154798795
Molecular FormulaC15H11N5O3S
Molecular Weight341.35 g/mol
Exact Mass341.06
IUPAC NameN-(6-hydroxy-1H-indazol-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
SMILESO=C(Cn1cnc2sccc2c1=O)Nc1n[nH]c2cc(O)ccc12
InChIInChI=1S/C15H11N5O3S/c21-8-1-2-9-11(5-8)18-19-13(9)17-12(22)6-20-7-16-14-10(15(20)23)3-4-24-14/h1-5,7,21H,6H2,(H2,17,18,19,22)
InChIKeyOFCGGPYXJURNQS-UHFFFAOYSA-N
XLogP1.68
TPSA112.90 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.35
LogP ≤ 51.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

2-(4-oxothieno[2,3-d]pyrimidin-3-yl)-N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]acetamide
CID 49382725
N-(3,5-dimethylphenyl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 18083656
N-(4-hydroxy-6-methyl-2-oxopyran-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 155969947
N-(1,2-oxazol-4-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 146131718
N-(2,5-dichlorophenyl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 17444773
2-(4-oxothieno[2,3-d]pyrimidin-3-yl)-N-(3-propan-2-ylpyrazin-2-yl)acetamide
CID 138051400
N-(5-methyl-1,3-thiazol-2-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 26197720
N-(methylcarbamoyl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 8594302
N-[4-bromo-3-(trifluoromethyl)phenyl]-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 17425297
(2R)-3-hydroxy-2-[[2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetyl]amino]propanoic acid
CID 80749574
(6-hydroxy-1H-indazol-3-yl)urea
CID 174460689
N-(3-tert-butyl-1,2-oxazol-5-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 38861918

Frequently Asked Questions

What is the IUPAC name of N-(6-hydroxy-1H-indazol-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide?
The IUPAC name of N-(6-hydroxy-1H-indazol-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide (CID 154798795) is N-(6-hydroxy-1H-indazol-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide.
What is the SMILES notation for N-(6-hydroxy-1H-indazol-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide?
The canonical SMILES for N-(6-hydroxy-1H-indazol-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide is O=C(Cn1cnc2sccc2c1=O)Nc1n[nH]c2cc(O)ccc12.
What is the InChIKey of N-(6-hydroxy-1H-indazol-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide?
The InChIKey is OFCGGPYXJURNQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N5O3S/c21-8-1-2-9-11(5-8)18-19-13(9)17-12(22)6-20-7-16-14-10(15(20)23)3-4-24-14/h1-5,7,21H,6H2,(H2,17,18,19,22).
What are the key properties of N-(6-hydroxy-1H-indazol-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide?
N-(6-hydroxy-1H-indazol-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide has a molecular weight of 341.35 g/mol, XLogP of 1.68, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-hydroxy-1H-indazol-3-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide is sourced from PubChem (CID 154798795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).