3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide

C23H17Cl2N3O2 — CID 46088105

IUPAC3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide
SMILESCOc1ccc(-c2cc(NC(=O)c3cc(Cl)cc(Cl)c3)n(-c3ccccc3)n2)cc1
InChIInChI=1S/C23H17Cl2N3O2/c1-30-20-9-7-15(8-10-20)21-14-22(28(27-21)19-5-3-2-4-6-19)26-23(29)16-11-17(24)13-18(25)12-16/h2-14H,1H3,(H,26,29)
InChIKeyOMMMWHGPLFYSRM-UHFFFAOYSA-N
MW438.31 g/mol
LogP6.11
Rot. Bonds5

About 3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide

3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide (PubChem CID 46088105) has the molecular formula C23H17Cl2N3O2 and a molecular weight of 438.31 g/mol. Its IUPAC name is 3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide.

Molecular Properties

Compound Name3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide
PubChem CID46088105
Molecular FormulaC23H17Cl2N3O2
Molecular Weight438.31 g/mol
Exact Mass437.07
IUPAC Name3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide
SMILESCOc1ccc(-c2cc(NC(=O)c3cc(Cl)cc(Cl)c3)n(-c3ccccc3)n2)cc1
InChIInChI=1S/C23H17Cl2N3O2/c1-30-20-9-7-15(8-10-20)21-14-22(28(27-21)19-5-3-2-4-6-19)26-23(29)16-11-17(24)13-18(25)12-16/h2-14H,1H3,(H,26,29)
InChIKeyOMMMWHGPLFYSRM-UHFFFAOYSA-N
XLogP6.11
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500438.31
LogP ≤ 56.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]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

3-chloro-N-[3-(4-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-5-yl]benzamide
CID 46088099
3-chloro-N-(1-phenyl-3-pyridin-4-ylpyrazol-5-yl)benzamide
CID 134799352
3-methoxy-N-(1-phenyl-3-pyridin-3-ylpyrazol-5-yl)benzamide
CID 134798353
3,5-dimethoxy-N-(5-methyl-2-phenylpyrazol-3-yl)benzamide
CID 2359886
4-fluoro-N-[3-(4-methylphenyl)-1-phenylpyrazol-5-yl]benzamide
CID 46087927
3-(4-methoxyphenyl)-1-phenyl-N-propan-2-ylpyrazole-5-carboxamide
CID 812061
1-benzyl-3-[1-(4-methoxyphenyl)-3-phenylpyrazol-5-yl]urea
CID 42732916
N-(4-methoxyphenyl)-1,3-diphenylpyrazole-5-carboxamide
CID 7900022
N-[1-(4-methoxyphenyl)-3-phenylpyrazol-5-yl]-3-methylsulfanylpropanamide
CID 46087824
N-(1,3-diphenylpyrazol-5-yl)-2-methyl-1,3-thiazole-4-carboxamide
CID 11473880
3-(4-methoxyphenyl)-1-phenylpyrazole-5-carboxamide
CID 10859327
N-ethyl-N-[2-[[1-(4-methoxyphenyl)-3-phenylpyrazol-5-yl]amino]-2-oxoethyl]-4-methylbenzamide
CID 1062173

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide?
The IUPAC name of 3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide (CID 46088105) is 3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide.
What is the SMILES notation for 3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide?
The canonical SMILES for 3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide is COc1ccc(-c2cc(NC(=O)c3cc(Cl)cc(Cl)c3)n(-c3ccccc3)n2)cc1.
What is the InChIKey of 3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide?
The InChIKey is OMMMWHGPLFYSRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17Cl2N3O2/c1-30-20-9-7-15(8-10-20)21-14-22(28(27-21)19-5-3-2-4-6-19)26-23(29)16-11-17(24)13-18(25)12-16/h2-14H,1H3,(H,26,29).
What are the key properties of 3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide?
3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide has a molecular weight of 438.31 g/mol, XLogP of 6.11, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-[3-(4-methoxyphenyl)-1-phenylpyrazol-5-yl]benzamide is sourced from PubChem (CID 46088105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).