3-bromo-5-chloro-N-(4-chlorophenyl)-2-methoxybenzamide

C14H10BrCl2NO2 — CID 67556921

IUPAC3-bromo-5-chloro-N-(4-chlorophenyl)-2-methoxybenzamide
SMILESCOc1c(Br)cc(Cl)cc1C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H10BrCl2NO2/c1-20-13-11(6-9(17)7-12(13)15)14(19)18-10-4-2-8(16)3-5-10/h2-7H,1H3,(H,18,19)
InChIKeyXQXDSJHPEMGICB-UHFFFAOYSA-N
MW375.05 g/mol
LogP5.02
Rot. Bonds3

About 3-bromo-5-chloro-N-(4-chlorophenyl)-2-methoxybenzamide

3-bromo-5-chloro-N-(4-chlorophenyl)-2-methoxybenzamide (PubChem CID 67556921) has the molecular formula C14H10BrCl2NO2 and a molecular weight of 375.05 g/mol. Its IUPAC name is 3-bromo-5-chloro-N-(4-chlorophenyl)-2-methoxybenzamide.

Molecular Properties

Compound Name3-bromo-5-chloro-N-(4-chlorophenyl)-2-methoxybenzamide
PubChem CID67556921
Molecular FormulaC14H10BrCl2NO2
Molecular Weight375.05 g/mol
Exact Mass372.93
IUPAC Name3-bromo-5-chloro-N-(4-chlorophenyl)-2-methoxybenzamide
SMILESCOc1c(Br)cc(Cl)cc1C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H10BrCl2NO2/c1-20-13-11(6-9(17)7-12(13)15)14(19)18-10-4-2-8(16)3-5-10/h2-7H,1H3,(H,18,19)
InChIKeyXQXDSJHPEMGICB-UHFFFAOYSA-N
XLogP5.02
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.05
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-dibromo-N-[4-[(3,5-dibromo-2-methoxybenzoyl)amino]phenyl]-2-methoxybenzamide
CID 5142163
3-bromo-N-(4-fluorophenyl)-2,5-dimethoxybenzamide
CID 24640379
3,5-dibromo-N-(3-chlorophenyl)-2-methoxybenzamide
CID 3324491
2-bromo-4-chloro-N-(4-methylphenyl)benzamide
CID 103763138
2-bromo-4-chloro-N-(3-chloro-4-methoxyphenyl)benzamide
CID 103763233
N-(4-chlorophenyl)-2,3,4-trimethoxybenzamide
CID 4794471
3,5-dibromo-N-(2,4-dichlorophenyl)-2-methoxybenzamide
CID 17111223
N-(4-acetylphenyl)-2-bromo-4-chlorobenzamide
CID 103763178
3-bromo-N-(3,4-dimethoxyphenyl)-2,5-dimethoxybenzamide
CID 17493489
5-bromo-N-(3-bromo-5-chloro-2-methoxyphenyl)-2-fluorobenzamide
CID 35206912
N-(4-chlorophenyl)-3,4,5-trimethoxybenzamide
CID 692739
N-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide
CID 63998623

Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-chloro-N-(4-chlorophenyl)-2-methoxybenzamide?
The IUPAC name of 3-bromo-5-chloro-N-(4-chlorophenyl)-2-methoxybenzamide (CID 67556921) is 3-bromo-5-chloro-N-(4-chlorophenyl)-2-methoxybenzamide.
What is the SMILES notation for 3-bromo-5-chloro-N-(4-chlorophenyl)-2-methoxybenzamide?
The canonical SMILES for 3-bromo-5-chloro-N-(4-chlorophenyl)-2-methoxybenzamide is COc1c(Br)cc(Cl)cc1C(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of 3-bromo-5-chloro-N-(4-chlorophenyl)-2-methoxybenzamide?
The InChIKey is XQXDSJHPEMGICB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrCl2NO2/c1-20-13-11(6-9(17)7-12(13)15)14(19)18-10-4-2-8(16)3-5-10/h2-7H,1H3,(H,18,19).
What are the key properties of 3-bromo-5-chloro-N-(4-chlorophenyl)-2-methoxybenzamide?
3-bromo-5-chloro-N-(4-chlorophenyl)-2-methoxybenzamide has a molecular weight of 375.05 g/mol, XLogP of 5.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-chloro-N-(4-chlorophenyl)-2-methoxybenzamide is sourced from PubChem (CID 67556921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).