N-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide

C23H16Cl2N2O2 — CID 5303659

IUPACN-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide
SMILESO=C(Nc1ccccc1Cl)C(=O)c1cn(Cc2ccc(Cl)cc2)c2ccccc12
InChIInChI=1S/C23H16Cl2N2O2/c24-16-11-9-15(10-12-16)13-27-14-18(17-5-1-4-8-21(17)27)22(28)23(29)26-20-7-3-2-6-19(20)25/h1-12,14H,13H2,(H,26,29)
InChIKeyUDPHKPGCMHHJNK-UHFFFAOYSA-N
MW423.30 g/mol
LogP5.82
Rot. Bonds5

About N-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide

N-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide (PubChem CID 5303659) has the molecular formula C23H16Cl2N2O2 and a molecular weight of 423.30 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide
PubChem CID5303659
Molecular FormulaC23H16Cl2N2O2
Molecular Weight423.30 g/mol
Exact Mass422.06
IUPAC NameN-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide
SMILESO=C(Nc1ccccc1Cl)C(=O)c1cn(Cc2ccc(Cl)cc2)c2ccccc12
InChIInChI=1S/C23H16Cl2N2O2/c24-16-11-9-15(10-12-16)13-27-14-18(17-5-1-4-8-21(17)27)22(28)23(29)26-20-7-3-2-6-19(20)25/h1-12,14H,13H2,(H,26,29)
InChIKeyUDPHKPGCMHHJNK-UHFFFAOYSA-N
XLogP5.82
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500423.30
LogP ≤ 55.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide?
The IUPAC name of N-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide (CID 5303659) is N-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide is O=C(Nc1ccccc1Cl)C(=O)c1cn(Cc2ccc(Cl)cc2)c2ccccc12.
What is the InChIKey of N-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide?
The InChIKey is UDPHKPGCMHHJNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16Cl2N2O2/c24-16-11-9-15(10-12-16)13-27-14-18(17-5-1-4-8-21(17)27)22(28)23(29)26-20-7-3-2-6-19(20)25/h1-12,14H,13H2,(H,26,29).
What are the key properties of N-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide?
N-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide has a molecular weight of 423.30 g/mol, XLogP of 5.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-oxoacetamide is sourced from PubChem (CID 5303659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).