N-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide

C11H8Cl2N4O2S — CID 155193461

IUPACN-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide
SMILESO=S(=O)(Nc1ccc(Cl)c2c(Cl)c[nH]c12)c1cn[nH]c1
InChIInChI=1S/C11H8Cl2N4O2S/c12-7-1-2-9(11-10(7)8(13)5-14-11)17-20(18,19)6-3-15-16-4-6/h1-5,14,17H,(H,15,16)
InChIKeyIEQXWHHOIXCSII-UHFFFAOYSA-N
MW331.18 g/mol
LogP3.00
Rot. Bonds3

About N-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide

N-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide (PubChem CID 155193461) has the molecular formula C11H8Cl2N4O2S and a molecular weight of 331.18 g/mol. Its IUPAC name is N-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide
PubChem CID155193461
Molecular FormulaC11H8Cl2N4O2S
Molecular Weight331.18 g/mol
Exact Mass329.97
IUPAC NameN-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide
SMILESO=S(=O)(Nc1ccc(Cl)c2c(Cl)c[nH]c12)c1cn[nH]c1
InChIInChI=1S/C11H8Cl2N4O2S/c12-7-1-2-9(11-10(7)8(13)5-14-11)17-20(18,19)6-3-15-16-4-6/h1-5,14,17H,(H,15,16)
InChIKeyIEQXWHHOIXCSII-UHFFFAOYSA-N
XLogP3.00
TPSA90.64 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.18
LogP ≤ 53.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-(3,4-dichloro-1H-indol-7-yl)benzene-1,4-disulfonamide
CID 22228546
N-(2,4-dichlorophenyl)-1H-pyrazole-4-sulfonamide
CID 47267509
N-(3,4-dichloro-1H-indol-7-yl)-1-(2-hydroxyethyl)pyrazole-4-sulfonamide
CID 155193283
N-(2-chloro-4-iodophenyl)-1H-pyrazole-4-sulfonamide
CID 47364015
N-(3,4-dichloro-1H-indol-7-yl)-4-(1-methylpyrazol-4-yl)benzenesulfonamide
CID 164863639
4-(4-aminocyclohexyl)oxy-N-(3,4-dichloro-1H-indol-7-yl)benzenesulfonamide
CID 164877468
methyl N-[2-chloro-4-[(3,4-dichloro-1H-indol-7-yl)sulfamoyl]phenyl]carbamate
CID 164863691
2-[(3,4-dichloro-1H-indol-7-yl)sulfamoyl]benzenesulfonyl fluoride
CID 175760561
3-cyano-N-(3,4-dichloro-1H-indol-7-yl)benzenesulfonamide
CID 164863478
N-(3,4-dichloro-1H-indol-7-yl)-4-(difluoromethoxy)-3-fluorobenzenesulfonamide
CID 164877886
N-(3,4-dichloro-1H-indol-7-yl)-4-piperidin-1-ylsulfinylbenzenesulfonamide
CID 164863600
N-(2-chloro-5-nitrophenyl)-1H-pyrazole-4-sulfonamide
CID 61248781

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide (CID 155193461) is N-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide is O=S(=O)(Nc1ccc(Cl)c2c(Cl)c[nH]c12)c1cn[nH]c1.
What is the InChIKey of N-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide?
The InChIKey is IEQXWHHOIXCSII-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl2N4O2S/c12-7-1-2-9(11-10(7)8(13)5-14-11)17-20(18,19)6-3-15-16-4-6/h1-5,14,17H,(H,15,16).
What are the key properties of N-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide?
N-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide has a molecular weight of 331.18 g/mol, XLogP of 3.00, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichloro-1H-indol-7-yl)-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 155193461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).