N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide

C28H25NO4S — CID 19217899

IUPACN-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide
SMILESCc1ccc(C)c(N(C(=O)COc2ccc(-c3ccccc3)cc2)S(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C28H25NO4S/c1-21-13-14-22(2)27(19-21)29(34(31,32)26-11-7-4-8-12-26)28(30)20-33-25-17-15-24(16-18-25)23-9-5-3-6-10-23/h3-19H,20H2,1-2H3
InChIKeyYAJBGCFAYHOHIG-UHFFFAOYSA-N
MW471.58 g/mol
LogP5.77
Rot. Bonds7

About N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide

N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide (PubChem CID 19217899) has the molecular formula C28H25NO4S and a molecular weight of 471.58 g/mol. Its IUPAC name is N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide.

Molecular Properties

Compound NameN-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide
PubChem CID19217899
Molecular FormulaC28H25NO4S
Molecular Weight471.58 g/mol
Exact Mass471.15
IUPAC NameN-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide
SMILESCc1ccc(C)c(N(C(=O)COc2ccc(-c3ccccc3)cc2)S(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C28H25NO4S/c1-21-13-14-22(2)27(19-21)29(34(31,32)26-11-7-4-8-12-26)28(30)20-33-25-17-15-24(16-18-25)23-9-5-3-6-10-23/h3-19H,20H2,1-2H3
InChIKeyYAJBGCFAYHOHIG-UHFFFAOYSA-N
XLogP5.77
TPSA63.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500471.58
LogP ≤ 55.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide 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-(benzenesulfonyl)-2-(4-chloro-3-methylphenoxy)-N-(2,5-dimethylphenyl)acetamide
CID 19217425
N-(4-chlorophenyl)sulfonyl-N-(2,5-dimethylphenyl)-2-[4-(2-phenylpropan-2-yl)phenoxy]acetamide
CID 19218271
N-(benzenesulfonyl)-2-(4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 19212675
2-(4-bromophenoxy)-N-(4-chlorophenyl)sulfonyl-N-(2,5-dimethylphenyl)acetamide
CID 19212751
N-(4-chlorophenyl)sulfonyl-N-(2,5-dimethylphenyl)-2-(4-ethylphenoxy)acetamide
CID 19212848
N-(4-methylphenyl)-N-(4-methylphenyl)sulfonyl-2-phenoxyacetamide
CID 19212618
N-(benzenesulfonyl)-2-(3,5-dimethylphenoxy)-N-(4-methylphenyl)acetamide
CID 19217513
N-(benzenesulfonyl)-N-(4-ethylphenyl)-2-(4-methylphenoxy)acetamide
CID 19212677
N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-4-methylbenzamide
CID 19210993
N-(4-chlorophenyl)sulfonyl-N-(2,5-dimethylphenyl)-4-phenoxybutanamide
CID 19218621
N-(4-ethoxyphenyl)-2-(4-methylphenoxy)-N-(4-methylphenyl)sulfonylacetamide
CID 19212681
N-(benzenesulfonyl)-2-(4-chloro-3-methylphenoxy)-N-phenylacetamide
CID 19217409

Frequently Asked Questions

What is the IUPAC name of N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide?
The IUPAC name of N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide (CID 19217899) is N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide.
What is the SMILES notation for N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide?
The canonical SMILES for N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide is Cc1ccc(C)c(N(C(=O)COc2ccc(-c3ccccc3)cc2)S(=O)(=O)c2ccccc2)c1.
What is the InChIKey of N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide?
The InChIKey is YAJBGCFAYHOHIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H25NO4S/c1-21-13-14-22(2)27(19-21)29(34(31,32)26-11-7-4-8-12-26)28(30)20-33-25-17-15-24(16-18-25)23-9-5-3-6-10-23/h3-19H,20H2,1-2H3.
What are the key properties of N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide?
N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide has a molecular weight of 471.58 g/mol, XLogP of 5.77, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-2-(4-phenylphenoxy)acetamide is sourced from PubChem (CID 19217899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).