ethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate

C17H19N5O5S — CID 58574041

IUPACethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate
SMILESCCOC(=O)c1cc(Oc2cnc(NS(C)(=O)=O)cn2)c2cn(CC)nc2c1
InChIInChI=1S/C17H19N5O5S/c1-4-22-10-12-13(20-22)6-11(17(23)26-5-2)7-14(12)27-16-9-18-15(8-19-16)21-28(3,24)25/h6-10H,4-5H2,1-3H3,(H,18,21)
InChIKeyPHBJPHASUUIULG-UHFFFAOYSA-N
MW405.44 g/mol
LogP2.19
Rot. Bonds7

About ethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate

ethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate (PubChem CID 58574041) has the molecular formula C17H19N5O5S and a molecular weight of 405.44 g/mol. Its IUPAC name is ethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate.

Molecular Properties

Compound Nameethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate
PubChem CID58574041
Molecular FormulaC17H19N5O5S
Molecular Weight405.44 g/mol
Exact Mass405.11
IUPAC Nameethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate
SMILESCCOC(=O)c1cc(Oc2cnc(NS(C)(=O)=O)cn2)c2cn(CC)nc2c1
InChIInChI=1S/C17H19N5O5S/c1-4-22-10-12-13(20-22)6-11(17(23)26-5-2)7-14(12)27-16-9-18-15(8-19-16)21-28(3,24)25/h6-10H,4-5H2,1-3H3,(H,18,21)
InChIKeyPHBJPHASUUIULG-UHFFFAOYSA-N
XLogP2.19
TPSA125.30 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.44
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Related Compounds

ethyl 2-ethyl-4-[5-[methyl(methylsulfonyl)amino]pyrazin-2-yl]oxyindazole-6-carboxylate
CID 58574101
4-(5-aminopyrazin-2-yl)oxy-2-ethylindazole-6-carboxylic acid
CID 123170198
4-(5-carbamoylpyrazin-2-yl)oxy-2-ethyl-N-(5-methyl-2-pyridinyl)indazole-6-carboxamide
CID 58574075
2-ethyl-N-(5-methylpyrazin-2-yl)-4-(4-sulfamoylphenoxy)indazole-6-carboxamide
CID 58574099
ethyl 4-[4-(dimethylsulfamoyl)phenoxy]-2-methylindazole-6-carboxylate
CID 58574059
ethyl 3-[(1-ethyl-3-methylpyrazol-4-yl)sulfonylamino]benzoate
CID 19683978
ethyl 4-hydroxy-3-(methanesulfonamido)benzoate
CID 18982707
ethyl 4-ethoxyquinoline-7-carboxylate
CID 91667888
4-[4-(dimethylsulfamoyl)phenoxy]-2-methyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide
CID 71457592
ethyl 2-(methanesulfonamido)pyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 150498169
ethyl 3-bromo-4-[(1-ethylpyrazol-4-yl)sulfamoyl]benzoate
CID 39836984
ethyl 3,5-bis[(5-cyano-2-pyridinyl)oxy]benzoate
CID 66818619

Frequently Asked Questions

What is the IUPAC name of ethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate?
The IUPAC name of ethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate (CID 58574041) is ethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate.
What is the SMILES notation for ethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate?
The canonical SMILES for ethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate is CCOC(=O)c1cc(Oc2cnc(NS(C)(=O)=O)cn2)c2cn(CC)nc2c1.
What is the InChIKey of ethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate?
The InChIKey is PHBJPHASUUIULG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O5S/c1-4-22-10-12-13(20-22)6-11(17(23)26-5-2)7-14(12)27-16-9-18-15(8-19-16)21-28(3,24)25/h6-10H,4-5H2,1-3H3,(H,18,21).
What are the key properties of ethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate?
ethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate has a molecular weight of 405.44 g/mol, XLogP of 2.19, 7 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate is sourced from PubChem (CID 58574041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).