N'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide

C14H10BrClN2O2 — CID 108516651

IUPACN'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide
SMILESO=C(Nc1ccc(Cl)cc1)C(=O)Nc1cccc(Br)c1
InChIInChI=1S/C14H10BrClN2O2/c15-9-2-1-3-12(8-9)18-14(20)13(19)17-11-6-4-10(16)5-7-11/h1-8H,(H,17,19)(H,18,20)
InChIKeyGZIHSTLWUJWPPK-UHFFFAOYSA-N
MW353.60 g/mol
LogP3.68
Rot. Bonds2

About N'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide

N'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide (PubChem CID 108516651) has the molecular formula C14H10BrClN2O2 and a molecular weight of 353.60 g/mol. Its IUPAC name is N'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide.

Molecular Properties

Compound NameN'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide
PubChem CID108516651
Molecular FormulaC14H10BrClN2O2
Molecular Weight353.60 g/mol
Exact Mass351.96
IUPAC NameN'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide
SMILESO=C(Nc1ccc(Cl)cc1)C(=O)Nc1cccc(Br)c1
InChIInChI=1S/C14H10BrClN2O2/c15-9-2-1-3-12(8-9)18-14(20)13(19)17-11-6-4-10(16)5-7-11/h1-8H,(H,17,19)(H,18,20)
InChIKeyGZIHSTLWUJWPPK-UHFFFAOYSA-N
XLogP3.68
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.60
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-(3-bromophenyl)-N-(4-fluorophenyl)oxamide
CID 108512623
N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide
CID 108516155
2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide
CID 9080372
N'-(3-bromophenyl)-N-(4-ethylphenyl)oxamide
CID 108522318
N-(3-bromophenyl)-N'-(2,6-difluorophenyl)oxamide
CID 108522076
N'-(3-bromophenyl)-N-(3-fluorophenyl)oxamide
CID 108529598
(E)-N-(3-bromophenyl)-3-(4-chlorophenyl)-2-cyanoprop-2-enamide
CID 1366410
N'-(3-bromophenyl)-N-(4-butylphenyl)oxamide
CID 108502479
N'-(3-bromophenyl)-N-(3-methoxyphenyl)oxamide
CID 108519610
N-(3-bromophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-6-yl)oxamide
CID 108987680
N-(3-bromophenyl)-N'-(2,6-diethylphenyl)oxamide
CID 108511493
2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide
CID 81271166

Frequently Asked Questions

What is the IUPAC name of N'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide?
The IUPAC name of N'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide (CID 108516651) is N'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide.
What is the SMILES notation for N'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide?
The canonical SMILES for N'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide is O=C(Nc1ccc(Cl)cc1)C(=O)Nc1cccc(Br)c1.
What is the InChIKey of N'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide?
The InChIKey is GZIHSTLWUJWPPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClN2O2/c15-9-2-1-3-12(8-9)18-14(20)13(19)17-11-6-4-10(16)5-7-11/h1-8H,(H,17,19)(H,18,20).
What are the key properties of N'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide?
N'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide has a molecular weight of 353.60 g/mol, XLogP of 3.68, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide is sourced from PubChem (CID 108516651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).