3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide

C34H28N2O3 — CID 141017154

IUPAC3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide
SMILESO=C(NCc1cccc(OCc2ccccc2)c1)NC(=O)c1ccc(-c2ccccc2)c(-c2ccccc2)c1
InChIInChI=1S/C34H28N2O3/c37-33(29-19-20-31(27-14-6-2-7-15-27)32(22-29)28-16-8-3-9-17-28)36-34(38)35-23-26-13-10-18-30(21-26)39-24-25-11-4-1-5-12-25/h1-22H,23-24H2,(H2,35,36,37,38)
InChIKeyYBKKVFPMOLSCIY-UHFFFAOYSA-N
MW512.61 g/mol
LogP7.24
Rot. Bonds8

About 3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide

3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide (PubChem CID 141017154) has the molecular formula C34H28N2O3 and a molecular weight of 512.61 g/mol. Its IUPAC name is 3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide.

Molecular Properties

Compound Name3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide
PubChem CID141017154
Molecular FormulaC34H28N2O3
Molecular Weight512.61 g/mol
Exact Mass512.21
IUPAC Name3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide
SMILESO=C(NCc1cccc(OCc2ccccc2)c1)NC(=O)c1ccc(-c2ccccc2)c(-c2ccccc2)c1
InChIInChI=1S/C34H28N2O3/c37-33(29-19-20-31(27-14-6-2-7-15-27)32(22-29)28-16-8-3-9-17-28)36-34(38)35-23-26-13-10-18-30(21-26)39-24-25-11-4-1-5-12-25/h1-22H,23-24H2,(H2,35,36,37,38)
InChIKeyYBKKVFPMOLSCIY-UHFFFAOYSA-N
XLogP7.24
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500512.61
LogP ≤ 57.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(3-phenylmethoxyphenyl)methyl]-2H-benzotriazole-5-carboxamide
CID 60515368
N-[(3-methylphenyl)methyl]-3-phenylmethoxybenzamide
CID 50875108
3-(dimethylamino)-N-[(3-phenylmethoxyphenyl)methyl]benzamide
CID 52685710
N-benzyl-3-[(4-cyanophenyl)methoxy]benzamide
CID 7492266
4-(dimethylsulfamoyl)-N-[(3-phenylmethoxyphenyl)methyl]benzamide
CID 52685715
N-[(3-ethoxyphenyl)methylcarbamoyl]-2-hydroxybenzamide
CID 142955511
(2R)-2-[(3-phenylmethoxyphenyl)methylamino]propanoic acid
CID 95003342
N-[[3-[4-(3-phenylphenoxy)butoxy]phenyl]methyl]benzamide
CID 173183634
2-phenyl-5-phenylmethoxyphenol
CID 123808909
2-phenyl-N-(2-phenylethyl)-5-phenylmethoxybenzamide
CID 16663785
3-nitro-N-[2-oxo-2-[(3-phenylmethoxyphenyl)methylamino]ethyl]benzamide
CID 60515233
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(3-phenylmethoxyphenyl)methyl]benzamide
CID 55846787

Frequently Asked Questions

What is the IUPAC name of 3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide?
The IUPAC name of 3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide (CID 141017154) is 3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide.
What is the SMILES notation for 3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide?
The canonical SMILES for 3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide is O=C(NCc1cccc(OCc2ccccc2)c1)NC(=O)c1ccc(-c2ccccc2)c(-c2ccccc2)c1.
What is the InChIKey of 3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide?
The InChIKey is YBKKVFPMOLSCIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H28N2O3/c37-33(29-19-20-31(27-14-6-2-7-15-27)32(22-29)28-16-8-3-9-17-28)36-34(38)35-23-26-13-10-18-30(21-26)39-24-25-11-4-1-5-12-25/h1-22H,23-24H2,(H2,35,36,37,38).
What are the key properties of 3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide?
3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide has a molecular weight of 512.61 g/mol, XLogP of 7.24, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-diphenyl-N-[(3-phenylmethoxyphenyl)methylcarbamoyl]benzamide is sourced from PubChem (CID 141017154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).