5-bromo-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide

C14H10BrCl2NO3 — CID 9320508

IUPAC5-bromo-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide
SMILESCOc1ccc(Br)cc1C(=O)Nc1cc(Cl)c(O)c(Cl)c1
InChIInChI=1S/C14H10BrCl2NO3/c1-21-12-3-2-7(15)4-9(12)14(20)18-8-5-10(16)13(19)11(17)6-8/h2-6,19H,1H3,(H,18,20)
InChIKeyHMKWDNYXZBWZOX-UHFFFAOYSA-N
MW391.05 g/mol
LogP4.72
Rot. Bonds3

About 5-bromo-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide

5-bromo-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide (PubChem CID 9320508) has the molecular formula C14H10BrCl2NO3 and a molecular weight of 391.05 g/mol. Its IUPAC name is 5-bromo-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide.

Molecular Properties

Compound Name5-bromo-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide
PubChem CID9320508
Molecular FormulaC14H10BrCl2NO3
Molecular Weight391.05 g/mol
Exact Mass388.92
IUPAC Name5-bromo-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide
SMILESCOc1ccc(Br)cc1C(=O)Nc1cc(Cl)c(O)c(Cl)c1
InChIInChI=1S/C14H10BrCl2NO3/c1-21-12-3-2-7(15)4-9(12)14(20)18-8-5-10(16)13(19)11(17)6-8/h2-6,19H,1H3,(H,18,20)
InChIKeyHMKWDNYXZBWZOX-UHFFFAOYSA-N
XLogP4.72
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.05
LogP ≤ 54.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-bromo-N-(2-chlorophenyl)-2-methoxybenzamide
CID 1121307
4-chloro-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide
CID 82880967
5-bromo-N-[4-[4-[(5-bromo-2-methoxybenzoyl)amino]phenoxy]phenyl]-2-methoxybenzamide
CID 17296371
5-bromo-N-[3-[(5-bromo-2-chlorobenzoyl)amino]-4-methoxyphenyl]-2-chlorobenzamide
CID 3910940
3-chloro-N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide
CID 2994955
5-bromo-N-(3-chloro-4-methoxyphenyl)-2-(2-methylpropoxy)benzamide
CID 17050839
N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-5-bromo-2-methoxybenzamide
CID 17111799
5-bromo-2-methoxy-N-[4-(2-methylpropanoylamino)phenyl]benzamide
CID 1299225
5-[(5-bromo-2-methoxybenzoyl)amino]-2-methylbenzoic acid
CID 17296186
5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide
CID 2529315
N-(4-bromo-2-chlorophenyl)-2-methoxy-5-methylbenzamide
CID 34054741
5-bromo-N-(4-bromo-2-iodophenyl)-2-methoxybenzamide
CID 4660639

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide?
The IUPAC name of 5-bromo-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide (CID 9320508) is 5-bromo-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide.
What is the SMILES notation for 5-bromo-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide?
The canonical SMILES for 5-bromo-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide is COc1ccc(Br)cc1C(=O)Nc1cc(Cl)c(O)c(Cl)c1.
What is the InChIKey of 5-bromo-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide?
The InChIKey is HMKWDNYXZBWZOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrCl2NO3/c1-21-12-3-2-7(15)4-9(12)14(20)18-8-5-10(16)13(19)11(17)6-8/h2-6,19H,1H3,(H,18,20).
What are the key properties of 5-bromo-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide?
5-bromo-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide has a molecular weight of 391.05 g/mol, XLogP of 4.72, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(3,5-dichloro-4-hydroxyphenyl)-2-methoxybenzamide is sourced from PubChem (CID 9320508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).