5-(4-chlorophenyl)sulfonyl-4-methyl-1,4-dihydropyrazolo[4,5-c]quinolin-7-ol

C17H14ClN3O3S — CID 135899156

IUPAC5-(4-chlorophenyl)sulfonyl-4-methyl-1,4-dihydropyrazolo[4,5-c]quinolin-7-ol
SMILESCC1c2cn[nH]c2-c2ccc(O)cc2N1S(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C17H14ClN3O3S/c1-10-15-9-19-20-17(15)14-7-4-12(22)8-16(14)21(10)25(23,24)13-5-2-11(18)3-6-13/h2-10,22H,1H3,(H,19,20)
InChIKeyLWOBGHMKQHIENT-UHFFFAOYSA-N
MW375.84 g/mol
LogP3.71
Rot. Bonds2

About 5-(4-chlorophenyl)sulfonyl-4-methyl-1,4-dihydropyrazolo[4,5-c]quinolin-7-ol

5-(4-chlorophenyl)sulfonyl-4-methyl-1,4-dihydropyrazolo[4,5-c]quinolin-7-ol (PubChem CID 135899156) has the molecular formula C17H14ClN3O3S and a molecular weight of 375.84 g/mol. Its IUPAC name is 5-(4-chlorophenyl)sulfonyl-4-methyl-1,4-dihydropyrazolo[4,5-c]quinolin-7-ol.

Molecular Properties

Compound Name5-(4-chlorophenyl)sulfonyl-4-methyl-1,4-dihydropyrazolo[4,5-c]quinolin-7-ol
PubChem CID135899156
Molecular FormulaC17H14ClN3O3S
Molecular Weight375.84 g/mol
Exact Mass375.04
IUPAC Name5-(4-chlorophenyl)sulfonyl-4-methyl-1,4-dihydropyrazolo[4,5-c]quinolin-7-ol
SMILESCC1c2cn[nH]c2-c2ccc(O)cc2N1S(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C17H14ClN3O3S/c1-10-15-9-19-20-17(15)14-7-4-12(22)8-16(14)21(10)25(23,24)13-5-2-11(18)3-6-13/h2-10,22H,1H3,(H,19,20)
InChIKeyLWOBGHMKQHIENT-UHFFFAOYSA-N
XLogP3.71
TPSA86.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.84
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)sulfonyl-4-methyl-1,4-dihydropyrazolo[4,5-c]quinolin-7-ol?
The IUPAC name of 5-(4-chlorophenyl)sulfonyl-4-methyl-1,4-dihydropyrazolo[4,5-c]quinolin-7-ol (CID 135899156) is 5-(4-chlorophenyl)sulfonyl-4-methyl-1,4-dihydropyrazolo[4,5-c]quinolin-7-ol.
What is the SMILES notation for 5-(4-chlorophenyl)sulfonyl-4-methyl-1,4-dihydropyrazolo[4,5-c]quinolin-7-ol?
The canonical SMILES for 5-(4-chlorophenyl)sulfonyl-4-methyl-1,4-dihydropyrazolo[4,5-c]quinolin-7-ol is CC1c2cn[nH]c2-c2ccc(O)cc2N1S(=O)(=O)c1ccc(Cl)cc1.
What is the InChIKey of 5-(4-chlorophenyl)sulfonyl-4-methyl-1,4-dihydropyrazolo[4,5-c]quinolin-7-ol?
The InChIKey is LWOBGHMKQHIENT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClN3O3S/c1-10-15-9-19-20-17(15)14-7-4-12(22)8-16(14)21(10)25(23,24)13-5-2-11(18)3-6-13/h2-10,22H,1H3,(H,19,20).
What are the key properties of 5-(4-chlorophenyl)sulfonyl-4-methyl-1,4-dihydropyrazolo[4,5-c]quinolin-7-ol?
5-(4-chlorophenyl)sulfonyl-4-methyl-1,4-dihydropyrazolo[4,5-c]quinolin-7-ol has a molecular weight of 375.84 g/mol, XLogP of 3.71, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)sulfonyl-4-methyl-1,4-dihydropyrazolo[4,5-c]quinolin-7-ol is sourced from PubChem (CID 135899156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).