7-(2,6-dichlorophenyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide

C26H17Cl2IN2O — CID 174440765

IUPAC7-(2,6-dichlorophenyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide
SMILESNC(=O)c1cccc2c1c1ccc(-c3c(Cl)cccc3Cl)cc1n2Cc1ccccc1I
InChIInChI=1S/C26H17Cl2IN2O/c27-19-7-4-8-20(28)24(19)15-11-12-17-23(13-15)31(14-16-5-1-2-9-21(16)29)22-10-3-6-18(25(17)22)26(30)32/h1-13H,14H2,(H2,30,32)
InChIKeyORZLNWQPRXAWTD-UHFFFAOYSA-N
MW571.25 g/mol
LogP7.52
Rot. Bonds4

About 7-(2,6-dichlorophenyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide

7-(2,6-dichlorophenyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide (PubChem CID 174440765) has the molecular formula C26H17Cl2IN2O and a molecular weight of 571.25 g/mol. Its IUPAC name is 7-(2,6-dichlorophenyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide.

Molecular Properties

Compound Name7-(2,6-dichlorophenyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide
PubChem CID174440765
Molecular FormulaC26H17Cl2IN2O
Molecular Weight571.25 g/mol
Exact Mass569.98
IUPAC Name7-(2,6-dichlorophenyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide
SMILESNC(=O)c1cccc2c1c1ccc(-c3c(Cl)cccc3Cl)cc1n2Cc1ccccc1I
InChIInChI=1S/C26H17Cl2IN2O/c27-19-7-4-8-20(28)24(19)15-11-12-17-23(13-15)31(14-16-5-1-2-9-21(16)29)22-10-3-6-18(25(17)22)26(30)32/h1-13H,14H2,(H2,30,32)
InChIKeyORZLNWQPRXAWTD-UHFFFAOYSA-N
XLogP7.52
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500571.25
LogP ≤ 57.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

7-chloro-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide
CID 174414775
7-(2,6-dichlorophenyl)-9-[(3-iodophenyl)methyl]carbazole-4-carboxamide
CID 174414314
7-(furan-2-yl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide
CID 174414539
7-(hydroxymethyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide
CID 174400343
9-[(4-acetamidophenyl)methyl]-7-(2,6-dichlorophenyl)carbazole-4-carboxamide
CID 174414749
7-(2,6-dichlorophenyl)-9-[[3-(trifluoromethyl)phenyl]methyl]carbazole-4-carboxamide
CID 174399747
9-[(3-cyanophenyl)methyl]-7-(2,6-dichlorophenyl)carbazole-4-carboxamide
CID 174414740
9-[(3-chloro-4-methoxyphenyl)methyl]-7-(2,6-dichlorophenyl)carbazole-4-carboxamide
CID 174401344
7-(2,6-dichlorophenyl)-9-[(3-ethoxyphenyl)methyl]carbazole-4-carboxamide
CID 174417522
7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide
CID 175233517
9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide
CID 174400340
7-(4-chlorophenyl)-9-[(2-methoxyphenyl)methyl]carbazole-4-carboxamide
CID 174417826

Frequently Asked Questions

What is the IUPAC name of 7-(2,6-dichlorophenyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide?
The IUPAC name of 7-(2,6-dichlorophenyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide (CID 174440765) is 7-(2,6-dichlorophenyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide.
What is the SMILES notation for 7-(2,6-dichlorophenyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide?
The canonical SMILES for 7-(2,6-dichlorophenyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide is NC(=O)c1cccc2c1c1ccc(-c3c(Cl)cccc3Cl)cc1n2Cc1ccccc1I.
What is the InChIKey of 7-(2,6-dichlorophenyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide?
The InChIKey is ORZLNWQPRXAWTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H17Cl2IN2O/c27-19-7-4-8-20(28)24(19)15-11-12-17-23(13-15)31(14-16-5-1-2-9-21(16)29)22-10-3-6-18(25(17)22)26(30)32/h1-13H,14H2,(H2,30,32).
What are the key properties of 7-(2,6-dichlorophenyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide?
7-(2,6-dichlorophenyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide has a molecular weight of 571.25 g/mol, XLogP of 7.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2,6-dichlorophenyl)-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide is sourced from PubChem (CID 174440765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).