5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide

C27H26Cl3FN2OSi — CID 24779978

IUPAC5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide
SMILESC[Si](C)(C)c1ccc(CN(CCc2ccc(Cl)c(Cl)c2)C(=O)c2c(F)c(Cl)cc3cc[nH]c23)cc1
InChIInChI=1S/C27H26Cl3FN2OSi/c1-35(2,3)20-7-4-18(5-8-20)16-33(13-11-17-6-9-21(28)22(29)14-17)27(34)24-25(31)23(30)15-19-10-12-32-26(19)24/h4-10,12,14-15,32H,11,13,16H2,1-3H3
InChIKeyGEYJXUWXDOXCOT-UHFFFAOYSA-N
MW547.96 g/mol
LogP7.70
Rot. Bonds7

About 5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide

5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide (PubChem CID 24779978) has the molecular formula C27H26Cl3FN2OSi and a molecular weight of 547.96 g/mol. Its IUPAC name is 5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide
PubChem CID24779978
Molecular FormulaC27H26Cl3FN2OSi
Molecular Weight547.96 g/mol
Exact Mass546.09
IUPAC Name5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide
SMILESC[Si](C)(C)c1ccc(CN(CCc2ccc(Cl)c(Cl)c2)C(=O)c2c(F)c(Cl)cc3cc[nH]c23)cc1
InChIInChI=1S/C27H26Cl3FN2OSi/c1-35(2,3)20-7-4-18(5-8-20)16-33(13-11-17-6-9-21(28)22(29)14-17)27(34)24-25(31)23(30)15-19-10-12-32-26(19)24/h4-10,12,14-15,32H,11,13,16H2,1-3H3
InChIKeyGEYJXUWXDOXCOT-UHFFFAOYSA-N
XLogP7.70
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500547.96
LogP ≤ 57.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide 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

N-[(4-tert-butylphenyl)methyl]-5-chloro-N-[2-[4-chloro-3-(trifluoromethyl)phenyl]ethyl]-6-fluoro-1H-indole-7-carboxamide
CID 11512471
5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-N-[(5,5-dimethyl-6,7-dihydro-4H-1-benzothiophen-2-yl)methyl]-6-fluoro-1H-indole-7-carboxamide
CID 67017776
N-[(4-tert-butylphenyl)methyl]-5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-1H-pyrrolo[2,3-c]pyridine-7-carboxamide
CID 24760873
3-chloro-2-fluoro-5-(trifluoromethyl)-N-[2-[3-(trifluoromethyl)phenyl]ethyl]-N-[(4-trimethylsilylphenyl)methyl]benzamide
CID 88930016
N-[(4-tert-butylphenyl)methyl]-5-chloro-N-[2-(3-chloro-4-fluorophenyl)ethyl]-1H-indole-7-carboxamide
CID 86603089
5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-N-[(2,2-difluoro-1,3-benzodioxol-5-yl)methyl]-1H-indole-7-carboxamide
CID 86603045
N-[(4-tert-butylphenyl)methyl]-N-[2-(3-chloro-4-fluorophenyl)ethyl]-1H-pyrrolo[2,3-c]pyridine-7-carboxamide
CID 24760410
5-chloro-N-[[3-chloro-4-(2-methoxypropan-2-yl)phenyl]methyl]-N-[2-(3,4-dichlorophenyl)ethyl]-1H-indole-7-carboxamide
CID 90766772
N-[(4-tert-butylphenyl)methyl]-3-chloro-N-[2-(2-chloro-4-pyridinyl)ethyl]-2-fluoro-5-(trifluoromethyl)benzamide
CID 24737788
N-[(4-tert-butylphenyl)methyl]-N-[2-(3,4-dichlorophenyl)ethyl]-2-fluoropyridine-3-carboxamide
CID 24738252
N-[(4-tert-butylphenyl)methyl]-N-[2-(3,4-difluorophenyl)ethyl]-1H-indole-7-carboxamide
CID 86603067
N-[(4-tert-butylphenyl)methyl]-3-chloro-N-[2-(3-chloro-4-fluorophenyl)ethyl]-2-fluoro-5-(trifluoromethyl)benzamide
CID 88930033

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide?
The IUPAC name of 5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide (CID 24779978) is 5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide.
What is the SMILES notation for 5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide?
The canonical SMILES for 5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide is C[Si](C)(C)c1ccc(CN(CCc2ccc(Cl)c(Cl)c2)C(=O)c2c(F)c(Cl)cc3cc[nH]c23)cc1.
What is the InChIKey of 5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide?
The InChIKey is GEYJXUWXDOXCOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H26Cl3FN2OSi/c1-35(2,3)20-7-4-18(5-8-20)16-33(13-11-17-6-9-21(28)22(29)14-17)27(34)24-25(31)23(30)15-19-10-12-32-26(19)24/h4-10,12,14-15,32H,11,13,16H2,1-3H3.
What are the key properties of 5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide?
5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide has a molecular weight of 547.96 g/mol, XLogP of 7.70, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-(3,4-dichlorophenyl)ethyl]-6-fluoro-N-[(4-trimethylsilylphenyl)methyl]-1H-indole-7-carboxamide is sourced from PubChem (CID 24779978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).