N-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide

C14H11BrClNO3 — CID 63998623

IUPACN-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide
SMILESCOc1ccc(NC(=O)c2cc(Cl)ccc2O)cc1Br
InChIInChI=1S/C14H11BrClNO3/c1-20-13-5-3-9(7-11(13)15)17-14(19)10-6-8(16)2-4-12(10)18/h2-7,18H,1H3,(H,17,19)
InChIKeyCSBKPMPZKNFOSW-UHFFFAOYSA-N
MW356.60 g/mol
LogP4.07
Rot. Bonds3

About N-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide

N-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide (PubChem CID 63998623) has the molecular formula C14H11BrClNO3 and a molecular weight of 356.60 g/mol. Its IUPAC name is N-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide
PubChem CID63998623
Molecular FormulaC14H11BrClNO3
Molecular Weight356.60 g/mol
Exact Mass354.96
IUPAC NameN-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide
SMILESCOc1ccc(NC(=O)c2cc(Cl)ccc2O)cc1Br
InChIInChI=1S/C14H11BrClNO3/c1-20-13-5-3-9(7-11(13)15)17-14(19)10-6-8(16)2-4-12(10)18/h2-7,18H,1H3,(H,17,19)
InChIKeyCSBKPMPZKNFOSW-UHFFFAOYSA-N
XLogP4.07
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.60
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-bromo-3-methoxyphenyl)-5-chloro-2-hydroxybenzamide
CID 82867994
5-chloro-2-hydroxy-N-(4-methoxy-3-methylphenyl)benzamide
CID 47317877
5-chloro-N-(4-ethoxy-3-methoxyphenyl)-2-hydroxybenzamide
CID 18128122
N-(4-bromo-3-methylphenyl)-5-chloro-2-hydroxybenzamide
CID 28532000
N-(4-bromo-3-methylphenyl)-5-chloro-2-methoxybenzamide
CID 2198688
N-(3-amino-4-bromophenyl)-5-chloro-2-hydroxybenzamide
CID 79767581
2-bromo-4-chloro-N-(3-chloro-4-methoxyphenyl)benzamide
CID 103763233
5-bromo-N-(4-fluoro-3-methoxyphenyl)-2-hydroxybenzamide
CID 105285229
5-chloro-N-(3,4-difluorophenyl)-2-methoxybenzamide
CID 842280
N-(3-bromo-4-methoxyphenyl)-2-fluoro-5-methylbenzamide
CID 63999813
5-chloro-2-hydroxy-N-(3-methoxy-5-methylphenyl)benzamide
CID 71462579
N-(3-amino-4-methoxyphenyl)-5-chloro-2-methoxybenzamide
CID 43599928

Frequently Asked Questions

What is the IUPAC name of N-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide?
The IUPAC name of N-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide (CID 63998623) is N-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide.
What is the SMILES notation for N-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide?
The canonical SMILES for N-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide is COc1ccc(NC(=O)c2cc(Cl)ccc2O)cc1Br.
What is the InChIKey of N-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide?
The InChIKey is CSBKPMPZKNFOSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrClNO3/c1-20-13-5-3-9(7-11(13)15)17-14(19)10-6-8(16)2-4-12(10)18/h2-7,18H,1H3,(H,17,19).
What are the key properties of N-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide?
N-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide has a molecular weight of 356.60 g/mol, XLogP of 4.07, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromo-4-methoxyphenyl)-5-chloro-2-hydroxybenzamide is sourced from PubChem (CID 63998623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).