1-(4-sulfamoylphenyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide

C15H14N6O3S — CID 135403018

IUPAC1-(4-sulfamoylphenyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide
SMILESNC(=O)c1nn(-c2ccc(S(N)(=O)=O)cc2)c2c1CCc1[nH]ncc1-2
InChIInChI=1S/C15H14N6O3S/c16-15(22)13-10-5-6-12-11(7-18-19-12)14(10)21(20-13)8-1-3-9(4-2-8)25(17,23)24/h1-4,7H,5-6H2,(H2,16,22)(H,18,19)(H2,17,23,24)
InChIKeyMGCAXDANYPKQKY-UHFFFAOYSA-N
MW358.38 g/mol
LogP0.11
Rot. Bonds3

About 1-(4-sulfamoylphenyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide

1-(4-sulfamoylphenyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide (PubChem CID 135403018) has the molecular formula C15H14N6O3S and a molecular weight of 358.38 g/mol. Its IUPAC name is 1-(4-sulfamoylphenyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide.

Molecular Properties

Compound Name1-(4-sulfamoylphenyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide
PubChem CID135403018
Molecular FormulaC15H14N6O3S
Molecular Weight358.38 g/mol
Exact Mass358.08
IUPAC Name1-(4-sulfamoylphenyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide
SMILESNC(=O)c1nn(-c2ccc(S(N)(=O)=O)cc2)c2c1CCc1[nH]ncc1-2
InChIInChI=1S/C15H14N6O3S/c16-15(22)13-10-5-6-12-11(7-18-19-12)14(10)21(20-13)8-1-3-9(4-2-8)25(17,23)24/h1-4,7H,5-6H2,(H2,16,22)(H,18,19)(H2,17,23,24)
InChIKeyMGCAXDANYPKQKY-UHFFFAOYSA-N
XLogP0.11
TPSA149.75 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.38
LogP ≤ 50.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-sulfamoylphenyl)-1H-indazole-3-carboxamide
CID 9926933
Tetrahydro-benzodipyrazole deriv. 7b
CID 135403019
Tetrahydro-benzodipyrazole deriv. 7c
CID 135403020
Tetrahydro-benzodipyrazole deriv. 7d
CID 135403021
Tetrahydro-benzodipyrazole deriv. 7f
CID 135403023
Tetrahydro-benzodipyrazole deriv. 7h
CID 135403024
Tetrahydro-benzodipyrazole deriv. 7i
CID 135403025
Tetrahydro-benzodipyrazole deriv. 7k
CID 135403027
Tetrahydro-benzodipyrazole deriv. 7l
CID 135403028
Tetrahydro-benzodipyrazole deriv. 7m
CID 135403029
Tetrahydro-benzodipyrazole deriv. 7o
CID 135403031
Tetrahydro-benzodipyrazole deriv. 7r
CID 135403034

Frequently Asked Questions

What is the IUPAC name of 1-(4-sulfamoylphenyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide?
The IUPAC name of 1-(4-sulfamoylphenyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide (CID 135403018) is 1-(4-sulfamoylphenyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide.
What is the SMILES notation for 1-(4-sulfamoylphenyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide?
The canonical SMILES for 1-(4-sulfamoylphenyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide is NC(=O)c1nn(-c2ccc(S(N)(=O)=O)cc2)c2c1CCc1[nH]ncc1-2.
What is the InChIKey of 1-(4-sulfamoylphenyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide?
The InChIKey is MGCAXDANYPKQKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N6O3S/c16-15(22)13-10-5-6-12-11(7-18-19-12)14(10)21(20-13)8-1-3-9(4-2-8)25(17,23)24/h1-4,7H,5-6H2,(H2,16,22)(H,18,19)(H2,17,23,24).
What are the key properties of 1-(4-sulfamoylphenyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide?
1-(4-sulfamoylphenyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide has a molecular weight of 358.38 g/mol, XLogP of 0.11, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-sulfamoylphenyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide is sourced from PubChem (CID 135403018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).