N-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide

C15H13BrClNO3 — CID 3529705

IUPACN-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(OC)c(Br)c2)cc1Cl
InChIInChI=1S/C15H13BrClNO3/c1-20-13-6-4-10(8-11(13)16)18-15(19)9-3-5-14(21-2)12(17)7-9/h3-8H,1-2H3,(H,18,19)
InChIKeyINGLZVGTODGPQS-UHFFFAOYSA-N
MW370.63 g/mol
LogP4.37
Rot. Bonds4

About N-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide

N-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide (PubChem CID 3529705) has the molecular formula C15H13BrClNO3 and a molecular weight of 370.63 g/mol. Its IUPAC name is N-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide.

Molecular Properties

Compound NameN-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide
PubChem CID3529705
Molecular FormulaC15H13BrClNO3
Molecular Weight370.63 g/mol
Exact Mass368.98
IUPAC NameN-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(OC)c(Br)c2)cc1Cl
InChIInChI=1S/C15H13BrClNO3/c1-20-13-6-4-10(8-11(13)16)18-15(19)9-3-5-14(21-2)12(17)7-9/h3-8H,1-2H3,(H,18,19)
InChIKeyINGLZVGTODGPQS-UHFFFAOYSA-N
XLogP4.37
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.63
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-3-chloro-N-(3-chloro-4-methoxyphenyl)benzamide
CID 81307448
N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide
CID 795184
3-chloro-4-methoxy-N-(4-methylphenyl)benzamide
CID 2976183
3-chloro-4-methoxy-N-(4-methoxyphenyl)benzamide
CID 44871411
4-bromo-N-(3-bromo-4-methoxyphenyl)-3-fluorobenzamide
CID 63997805
3-bromo-N-(4-bromo-3-methylphenyl)-4-methoxybenzamide
CID 3493450
3-bromo-N-(3-bromo-4-fluorophenyl)-4-methoxybenzamide
CID 115661540
3-chloro-N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide
CID 2994955
3-bromo-N-[3-[(2-chlorobenzoyl)amino]phenyl]-4-methoxybenzamide
CID 1333423
N-[(3-bromo-4-methoxyphenyl)carbamothioyl]-3-chloro-4-methylbenzamide
CID 5090006
3-amino-N-(4-bromo-3-chlorophenyl)-4-methoxybenzamide
CID 107618351
3-chloro-N-[4-chloro-3-(trifluoromethyl)phenyl]-4-methoxybenzamide
CID 44871489

Frequently Asked Questions

What is the IUPAC name of N-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide?
The IUPAC name of N-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide (CID 3529705) is N-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide.
What is the SMILES notation for N-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide?
The canonical SMILES for N-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide is COc1ccc(C(=O)Nc2ccc(OC)c(Br)c2)cc1Cl.
What is the InChIKey of N-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide?
The InChIKey is INGLZVGTODGPQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrClNO3/c1-20-13-6-4-10(8-11(13)16)18-15(19)9-3-5-14(21-2)12(17)7-9/h3-8H,1-2H3,(H,18,19).
What are the key properties of N-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide?
N-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide has a molecular weight of 370.63 g/mol, XLogP of 4.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide is sourced from PubChem (CID 3529705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).