N-[4-(tert-butylsulfamoyl)phenyl]-2,2-diphenylacetamide

C24H26N2O3S — CID 1295481

IUPACN-[4-(tert-butylsulfamoyl)phenyl]-2,2-diphenylacetamide
SMILESCC(C)(C)NS(=O)(=O)c1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H26N2O3S/c1-24(2,3)26-30(28,29)21-16-14-20(15-17-21)25-23(27)22(18-10-6-4-7-11-18)19-12-8-5-9-13-19/h4-17,22,26H,1-3H3,(H,25,27)
InChIKeyIGUNPXRRXNSROQ-UHFFFAOYSA-N
MW422.55 g/mol
LogP4.53
Rot. Bonds6

About N-[4-(tert-butylsulfamoyl)phenyl]-2,2-diphenylacetamide

N-[4-(tert-butylsulfamoyl)phenyl]-2,2-diphenylacetamide (PubChem CID 1295481) has the molecular formula C24H26N2O3S and a molecular weight of 422.55 g/mol. Its IUPAC name is N-[4-(tert-butylsulfamoyl)phenyl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[4-(tert-butylsulfamoyl)phenyl]-2,2-diphenylacetamide
PubChem CID1295481
Molecular FormulaC24H26N2O3S
Molecular Weight422.55 g/mol
Exact Mass422.17
IUPAC NameN-[4-(tert-butylsulfamoyl)phenyl]-2,2-diphenylacetamide
SMILESCC(C)(C)NS(=O)(=O)c1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H26N2O3S/c1-24(2,3)26-30(28,29)21-16-14-20(15-17-21)25-23(27)22(18-10-6-4-7-11-18)19-12-8-5-9-13-19/h4-17,22,26H,1-3H3,(H,25,27)
InChIKeyIGUNPXRRXNSROQ-UHFFFAOYSA-N
XLogP4.53
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.55
LogP ≤ 54.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-(tert-butylsulfamoyl)phenyl]-2,2-diphenylacetamide?
The IUPAC name of N-[4-(tert-butylsulfamoyl)phenyl]-2,2-diphenylacetamide (CID 1295481) is N-[4-(tert-butylsulfamoyl)phenyl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[4-(tert-butylsulfamoyl)phenyl]-2,2-diphenylacetamide?
The canonical SMILES for N-[4-(tert-butylsulfamoyl)phenyl]-2,2-diphenylacetamide is CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-[4-(tert-butylsulfamoyl)phenyl]-2,2-diphenylacetamide?
The InChIKey is IGUNPXRRXNSROQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3S/c1-24(2,3)26-30(28,29)21-16-14-20(15-17-21)25-23(27)22(18-10-6-4-7-11-18)19-12-8-5-9-13-19/h4-17,22,26H,1-3H3,(H,25,27).
What are the key properties of N-[4-(tert-butylsulfamoyl)phenyl]-2,2-diphenylacetamide?
N-[4-(tert-butylsulfamoyl)phenyl]-2,2-diphenylacetamide has a molecular weight of 422.55 g/mol, XLogP of 4.53, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(tert-butylsulfamoyl)phenyl]-2,2-diphenylacetamide is sourced from PubChem (CID 1295481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).