N-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide

C16H11Br2ClN2O — CID 4063742

IUPACN-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide
SMILESO=C(Cn1ccc2cc(Br)ccc21)Nc1ccc(Br)c(Cl)c1
InChIInChI=1S/C16H11Br2ClN2O/c17-11-1-4-15-10(7-11)5-6-21(15)9-16(22)20-12-2-3-13(18)14(19)8-12/h1-8H,9H2,(H,20,22)
InChIKeyQAPLVFABOYHUQG-UHFFFAOYSA-N
MW442.54 g/mol
LogP5.46
Rot. Bonds3

About N-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide

N-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide (PubChem CID 4063742) has the molecular formula C16H11Br2ClN2O and a molecular weight of 442.54 g/mol. Its IUPAC name is N-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide
PubChem CID4063742
Molecular FormulaC16H11Br2ClN2O
Molecular Weight442.54 g/mol
Exact Mass439.89
IUPAC NameN-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide
SMILESO=C(Cn1ccc2cc(Br)ccc21)Nc1ccc(Br)c(Cl)c1
InChIInChI=1S/C16H11Br2ClN2O/c17-11-1-4-15-10(7-11)5-6-21(15)9-16(22)20-12-2-3-13(18)14(19)8-12/h1-8H,9H2,(H,20,22)
InChIKeyQAPLVFABOYHUQG-UHFFFAOYSA-N
XLogP5.46
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500442.54
LogP ≤ 55.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide 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-(5-bromoindol-1-yl)-N-(4-bromophenyl)acetamide
CID 4291378
2-(5-bromoindol-1-yl)-N-(3,4-dimethoxyphenyl)acetamide
CID 42537123
2-(5-bromoindol-1-yl)-N-(2,5-dichlorophenyl)acetamide
CID 4571080
2-(5-bromoindol-1-yl)-N-(1H-indol-5-yl)acetamide
CID 42507122
N-(2-bromo-4,5-dimethylphenyl)-2-(5-bromoindol-1-yl)acetamide
CID 4048909
2-(6-bromoindol-1-yl)-N-(3-chlorophenyl)acetamide
CID 116621944
N-(4-bromo-3-methylphenyl)-2-indol-1-ylacetamide
CID 4058006
2-(5-bromoindol-1-yl)-N-(2,3,4-trifluorophenyl)acetamide
CID 4070259
N-(4-bromo-3-chlorophenyl)-2-(triazol-1-yl)acetamide
CID 103824714
2-(5-bromoindol-1-yl)-N-[(1S)-1-phenylethyl]acetamide
CID 40631420
2-(5-bromoindol-1-yl)-N-(1,3-thiazol-2-yl)acetamide
CID 3420795
N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
CID 43833238

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide?
The IUPAC name of N-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide (CID 4063742) is N-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide.
What is the SMILES notation for N-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide?
The canonical SMILES for N-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide is O=C(Cn1ccc2cc(Br)ccc21)Nc1ccc(Br)c(Cl)c1.
What is the InChIKey of N-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide?
The InChIKey is QAPLVFABOYHUQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11Br2ClN2O/c17-11-1-4-15-10(7-11)5-6-21(15)9-16(22)20-12-2-3-13(18)14(19)8-12/h1-8H,9H2,(H,20,22).
What are the key properties of N-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide?
N-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide has a molecular weight of 442.54 g/mol, XLogP of 5.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-3-chlorophenyl)-2-(5-bromoindol-1-yl)acetamide is sourced from PubChem (CID 4063742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).