N-(2-benzoyl-4-bromophenyl)-5-(2-chlorophenyl)furan-2-carboxamide

C24H15BrClNO3 — CID 5262426

IUPACN-(2-benzoyl-4-bromophenyl)-5-(2-chlorophenyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(Br)cc1C(=O)c1ccccc1)c1ccc(-c2ccccc2Cl)o1
InChIInChI=1S/C24H15BrClNO3/c25-16-10-11-20(18(14-16)23(28)15-6-2-1-3-7-15)27-24(29)22-13-12-21(30-22)17-8-4-5-9-19(17)26/h1-14H,(H,27,29)
InChIKeyJGZZBZUZTIXLMA-UHFFFAOYSA-N
MW480.75 g/mol
LogP6.85
Rot. Bonds5

About N-(2-benzoyl-4-bromophenyl)-5-(2-chlorophenyl)furan-2-carboxamide

N-(2-benzoyl-4-bromophenyl)-5-(2-chlorophenyl)furan-2-carboxamide (PubChem CID 5262426) has the molecular formula C24H15BrClNO3 and a molecular weight of 480.75 g/mol. Its IUPAC name is N-(2-benzoyl-4-bromophenyl)-5-(2-chlorophenyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-benzoyl-4-bromophenyl)-5-(2-chlorophenyl)furan-2-carboxamide
PubChem CID5262426
Molecular FormulaC24H15BrClNO3
Molecular Weight480.75 g/mol
Exact Mass478.99
IUPAC NameN-(2-benzoyl-4-bromophenyl)-5-(2-chlorophenyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(Br)cc1C(=O)c1ccccc1)c1ccc(-c2ccccc2Cl)o1
InChIInChI=1S/C24H15BrClNO3/c25-16-10-11-20(18(14-16)23(28)15-6-2-1-3-7-15)27-24(29)22-13-12-21(30-22)17-8-4-5-9-19(17)26/h1-14H,(H,27,29)
InChIKeyJGZZBZUZTIXLMA-UHFFFAOYSA-N
XLogP6.85
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500480.75
LogP ≤ 56.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-benzoyl-4-chlorophenyl)-5-(2,3-dichlorophenyl)furan-2-carboxamide
CID 2066709
N-(2-amino-4-bromophenyl)-5-(3-chloro-2-methylphenyl)furan-2-carboxamide
CID 91687495
N-(2-benzoyl-4-bromophenyl)-5-chloro-2-methoxybenzamide
CID 4546153
5-(2-chlorophenyl)-N-(2-cyanophenyl)furan-2-carboxamide
CID 944882
5-(2-chlorophenyl)-N-(5-fluoro-2-methylphenyl)furan-2-carboxamide
CID 9077694
N-(4-bromo-2-fluorophenyl)-5-(2,4-dichlorophenyl)furan-2-carboxamide
CID 2238913
N-(2-amino-4-bromophenyl)-5-(2-bromophenyl)furan-2-carboxamide
CID 91687442
(2-benzoyl-4-bromophenyl)thiourea
CID 169360025
N-(4-amino-2-chlorophenyl)-5-(2-bromophenyl)furan-2-carboxamide
CID 100829833
5-(2-chlorophenyl)-N-(3-fluorophenyl)furan-2-carboxamide
CID 9072315
N-(2-benzoyl-4-bromophenyl)naphthalene-2-carboxamide
CID 23941186
5-(2-chlorophenyl)-N-(2-thiophen-2-ylphenyl)furan-2-carboxamide
CID 18224856

Frequently Asked Questions

What is the IUPAC name of N-(2-benzoyl-4-bromophenyl)-5-(2-chlorophenyl)furan-2-carboxamide?
The IUPAC name of N-(2-benzoyl-4-bromophenyl)-5-(2-chlorophenyl)furan-2-carboxamide (CID 5262426) is N-(2-benzoyl-4-bromophenyl)-5-(2-chlorophenyl)furan-2-carboxamide.
What is the SMILES notation for N-(2-benzoyl-4-bromophenyl)-5-(2-chlorophenyl)furan-2-carboxamide?
The canonical SMILES for N-(2-benzoyl-4-bromophenyl)-5-(2-chlorophenyl)furan-2-carboxamide is O=C(Nc1ccc(Br)cc1C(=O)c1ccccc1)c1ccc(-c2ccccc2Cl)o1.
What is the InChIKey of N-(2-benzoyl-4-bromophenyl)-5-(2-chlorophenyl)furan-2-carboxamide?
The InChIKey is JGZZBZUZTIXLMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15BrClNO3/c25-16-10-11-20(18(14-16)23(28)15-6-2-1-3-7-15)27-24(29)22-13-12-21(30-22)17-8-4-5-9-19(17)26/h1-14H,(H,27,29).
What are the key properties of N-(2-benzoyl-4-bromophenyl)-5-(2-chlorophenyl)furan-2-carboxamide?
N-(2-benzoyl-4-bromophenyl)-5-(2-chlorophenyl)furan-2-carboxamide has a molecular weight of 480.75 g/mol, XLogP of 6.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzoyl-4-bromophenyl)-5-(2-chlorophenyl)furan-2-carboxamide is sourced from PubChem (CID 5262426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).