N-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide

C22H24Cl2N2O3S — CID 46947932

IUPACN-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide
SMILESCC1(Cc2ccc(Cl)c(Cl)c2)C(=O)Nc2ccc(S(=O)(=O)NC3CCCCC3)cc21
InChIInChI=1S/C22H24Cl2N2O3S/c1-22(13-14-7-9-18(23)19(24)11-14)17-12-16(8-10-20(17)25-21(22)27)30(28,29)26-15-5-3-2-4-6-15/h7-12,15,26H,2-6,13H2,1H3,(H,25,27)
InChIKeyALDVKAXQFVDGPL-UHFFFAOYSA-N
MW467.42 g/mol
LogP5.06
Rot. Bonds5

About N-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide

N-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide (PubChem CID 46947932) has the molecular formula C22H24Cl2N2O3S and a molecular weight of 467.42 g/mol. Its IUPAC name is N-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide
PubChem CID46947932
Molecular FormulaC22H24Cl2N2O3S
Molecular Weight467.42 g/mol
Exact Mass466.09
IUPAC NameN-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide
SMILESCC1(Cc2ccc(Cl)c(Cl)c2)C(=O)Nc2ccc(S(=O)(=O)NC3CCCCC3)cc21
InChIInChI=1S/C22H24Cl2N2O3S/c1-22(13-14-7-9-18(23)19(24)11-14)17-12-16(8-10-20(17)25-21(22)27)30(28,29)26-15-5-3-2-4-6-15/h7-12,15,26H,2-6,13H2,1H3,(H,25,27)
InChIKeyALDVKAXQFVDGPL-UHFFFAOYSA-N
XLogP5.06
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500467.42
LogP ≤ 55.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[1-[(3,4-Dichlorophenyl)methyl]-2-oxo-5-piperidin-1-ylsulfonylindol-3-ylidene]propanedinitrile
CID 42618280
1-Acetyl-N-[2-(4-chlorophenyl)ethyl]-2-methyl-2,3-dihydro-1H-indole-5-sulfonamide
CID 20853143
5-[4-(3-Chlorophenyl)piperazin-1-yl]sulfonyl-1,3-dihydroindol-2-one
CID 16007461
2-(1-Acetyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-(4-chlorophenyl)-3-phenylpropanamide
CID 16020225
N-[2-(4-chlorophenyl)ethyl]-1-methyl-2-oxo-3H-indole-5-sulfonamide
CID 16021478
N-(5-Chloro-2-methylphenyl)-2-[3,3-dimethyl-2-oxo-5-(piperidine-1-sulfonyl)-2,3-dihydro-1H-indol-1-YL]acetamide
CID 16031595
N-(4-chlorophenyl)-1-[(1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indol-5-yl)sulfonyl]piperidine-3-carboxamide
CID 20900935
N-[(4-Chlorophenyl)methyl]-1-[(1,3,3-trimethyl-2-oxo-2,3-dihydro-1H-indol-5-YL)sulfonyl]piperidine-3-carboxamide
CID 20900953
N-[(2-chlorophenyl)methyl]-3-methyl-2-[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]butanamide
CID 20969895
2-(benzylamino)-5-(3,4-dichlorophenyl)-1-(1-methylsulfonylspiro[2H-indole-3,4'-piperidine]-1'-yl)pentan-1-one
CID 44297434
2-(benzylamino)-4-(3,4-dichlorophenyl)-1-(1-methylsulfonylspiro[2H-indole-3,4'-piperidine]-1'-yl)butan-1-one
CID 44297724
3-[(4-chlorophenyl)methyl]-N-cyclohexyl-3-methyl-2-oxo-1H-indole-5-sulfonamide
CID 46948020

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide?
The IUPAC name of N-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide (CID 46947932) is N-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide.
What is the SMILES notation for N-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide?
The canonical SMILES for N-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide is CC1(Cc2ccc(Cl)c(Cl)c2)C(=O)Nc2ccc(S(=O)(=O)NC3CCCCC3)cc21.
What is the InChIKey of N-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide?
The InChIKey is ALDVKAXQFVDGPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24Cl2N2O3S/c1-22(13-14-7-9-18(23)19(24)11-14)17-12-16(8-10-20(17)25-21(22)27)30(28,29)26-15-5-3-2-4-6-15/h7-12,15,26H,2-6,13H2,1H3,(H,25,27).
What are the key properties of N-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide?
N-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide has a molecular weight of 467.42 g/mol, XLogP of 5.06, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-[(3,4-dichlorophenyl)methyl]-3-methyl-2-oxo-1H-indole-5-sulfonamide is sourced from PubChem (CID 46947932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).