4-bromo-N-(3-chlorophenyl)-2-phenylmethoxybenzamide

C20H15BrClNO2 — CID 11327512

IUPAC4-bromo-N-(3-chlorophenyl)-2-phenylmethoxybenzamide
SMILESO=C(Nc1cccc(Cl)c1)c1ccc(Br)cc1OCc1ccccc1
InChIInChI=1S/C20H15BrClNO2/c21-15-9-10-18(20(24)23-17-8-4-7-16(22)12-17)19(11-15)25-13-14-5-2-1-3-6-14/h1-12H,13H2,(H,23,24)
InChIKeyVPVDNTZHPPYEGI-UHFFFAOYSA-N
MW416.70 g/mol
LogP5.93
Rot. Bonds5

About 4-bromo-N-(3-chlorophenyl)-2-phenylmethoxybenzamide

4-bromo-N-(3-chlorophenyl)-2-phenylmethoxybenzamide (PubChem CID 11327512) has the molecular formula C20H15BrClNO2 and a molecular weight of 416.70 g/mol. Its IUPAC name is 4-bromo-N-(3-chlorophenyl)-2-phenylmethoxybenzamide.

Molecular Properties

Compound Name4-bromo-N-(3-chlorophenyl)-2-phenylmethoxybenzamide
PubChem CID11327512
Molecular FormulaC20H15BrClNO2
Molecular Weight416.70 g/mol
Exact Mass415.00
IUPAC Name4-bromo-N-(3-chlorophenyl)-2-phenylmethoxybenzamide
SMILESO=C(Nc1cccc(Cl)c1)c1ccc(Br)cc1OCc1ccccc1
InChIInChI=1S/C20H15BrClNO2/c21-15-9-10-18(20(24)23-17-8-4-7-16(22)12-17)19(11-15)25-13-14-5-2-1-3-6-14/h1-12H,13H2,(H,23,24)
InChIKeyVPVDNTZHPPYEGI-UHFFFAOYSA-N
XLogP5.93
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.70
LogP ≤ 55.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-2-chloro-N-(4-phenylmethoxyphenyl)benzamide
CID 2953641
N-(3-ethylphenyl)-2,4-bis(phenylmethoxy)benzamide
CID 69249899
N-(3-fluorophenyl)-2,4-bis(phenylmethoxy)benzamide
CID 69250543
4-[(2-carboxybenzoyl)amino]-2-phenylmethoxybenzoic acid
CID 66574423
N-(3-chlorophenyl)-3-ethoxy-4-phenylmethoxybenzamide
CID 2192184
N-(3-chlorophenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 9243538
4-bromo-2-methoxy-N-[3-(methoxymethyl)phenyl]benzamide
CID 78987937
N-(3-chlorophenyl)-3-iodo-4-methoxy-5-phenylmethoxybenzamide
CID 3558686
4-bromo-N-[3-(hydroxymethyl)phenyl]-2-methoxybenzamide
CID 78988027
5-bromo-N-(3-chlorophenyl)-2-propan-2-yloxybenzamide
CID 17051414
2-[(3-bromophenyl)methoxy]-N-[3-(methylcarbamoyl)phenyl]benzamide
CID 43000565
5-bromo-N-(3-chlorophenyl)-2-(3-methylbutoxy)benzamide
CID 17350678

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(3-chlorophenyl)-2-phenylmethoxybenzamide?
The IUPAC name of 4-bromo-N-(3-chlorophenyl)-2-phenylmethoxybenzamide (CID 11327512) is 4-bromo-N-(3-chlorophenyl)-2-phenylmethoxybenzamide.
What is the SMILES notation for 4-bromo-N-(3-chlorophenyl)-2-phenylmethoxybenzamide?
The canonical SMILES for 4-bromo-N-(3-chlorophenyl)-2-phenylmethoxybenzamide is O=C(Nc1cccc(Cl)c1)c1ccc(Br)cc1OCc1ccccc1.
What is the InChIKey of 4-bromo-N-(3-chlorophenyl)-2-phenylmethoxybenzamide?
The InChIKey is VPVDNTZHPPYEGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15BrClNO2/c21-15-9-10-18(20(24)23-17-8-4-7-16(22)12-17)19(11-15)25-13-14-5-2-1-3-6-14/h1-12H,13H2,(H,23,24).
What are the key properties of 4-bromo-N-(3-chlorophenyl)-2-phenylmethoxybenzamide?
4-bromo-N-(3-chlorophenyl)-2-phenylmethoxybenzamide has a molecular weight of 416.70 g/mol, XLogP of 5.93, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(3-chlorophenyl)-2-phenylmethoxybenzamide is sourced from PubChem (CID 11327512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).