N-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide

C14H11Cl2N3O2S — CID 22567293

IUPACN-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide
SMILESCc1[nH]nc2ccc(S(=O)(=O)Nc3ccc(Cl)c(Cl)c3)cc12
InChIInChI=1S/C14H11Cl2N3O2S/c1-8-11-7-10(3-5-14(11)18-17-8)22(20,21)19-9-2-4-12(15)13(16)6-9/h2-7,19H,1H3,(H,17,18)
InChIKeyKFCJWDCLXKTDKE-UHFFFAOYSA-N
MW356.23 g/mol
LogP3.98
Rot. Bonds3

About N-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide

N-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide (PubChem CID 22567293) has the molecular formula C14H11Cl2N3O2S and a molecular weight of 356.23 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide
PubChem CID22567293
Molecular FormulaC14H11Cl2N3O2S
Molecular Weight356.23 g/mol
Exact Mass354.99
IUPAC NameN-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide
SMILESCc1[nH]nc2ccc(S(=O)(=O)Nc3ccc(Cl)c(Cl)c3)cc12
InChIInChI=1S/C14H11Cl2N3O2S/c1-8-11-7-10(3-5-14(11)18-17-8)22(20,21)19-9-2-4-12(15)13(16)6-9/h2-7,19H,1H3,(H,17,18)
InChIKeyKFCJWDCLXKTDKE-UHFFFAOYSA-N
XLogP3.98
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.23
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-dichlorophenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 26952341
N-(3,4-dichlorophenyl)-4-fluorobenzenesulfonamide
CID 711099
4-chloro-N-(3-chloro-4-methylphenyl)-3-methylbenzenesulfonamide
CID 16644802
N-[5-[(3,4-dichlorophenyl)sulfamoyl]-1H-indazol-3-yl]benzamide
CID 22567162
4-cyano-N-(3,4-dichlorophenyl)-3-methylbenzenesulfonamide
CID 106919707
N-(3,4-dichlorophenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629126
methyl 2-[2-chloro-4-[(3,4-dichlorophenyl)sulfamoyl]phenoxy]acetate
CID 2206278
N-(3,4-dichlorophenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 9055840
3-chloro-4-cyano-N-(3,4-dichlorophenyl)benzenesulfonamide
CID 115588612
N-[4-[(3,4-dichlorophenyl)sulfamoyl]phenyl]-2,5-dimethylbenzenesulfonamide
CID 22202667
N-(3-chloro-2H-indazol-5-yl)-3,5-bis(trifluoromethyl)benzenesulfonamide
CID 2780299
N-(3-chloro-4-fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 2683530

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide?
The IUPAC name of N-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide (CID 22567293) is N-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide is Cc1[nH]nc2ccc(S(=O)(=O)Nc3ccc(Cl)c(Cl)c3)cc12.
What is the InChIKey of N-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide?
The InChIKey is KFCJWDCLXKTDKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2N3O2S/c1-8-11-7-10(3-5-14(11)18-17-8)22(20,21)19-9-2-4-12(15)13(16)6-9/h2-7,19H,1H3,(H,17,18).
What are the key properties of N-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide?
N-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide has a molecular weight of 356.23 g/mol, XLogP of 3.98, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide is sourced from PubChem (CID 22567293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).