4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide

C15H18N2O4S2 — CID 1309244

IUPAC4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide
SMILESCS(=O)(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C15H18N2O4S2/c1-22(18,19)17-14-7-9-15(10-8-14)23(20,21)16-12-11-13-5-3-2-4-6-13/h2-10,16-17H,11-12H2,1H3
InChIKeyPXCZLFVLOSKJQN-UHFFFAOYSA-N
MW354.45 g/mol
LogP1.58
Rot. Bonds7

About 4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide

4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide (PubChem CID 1309244) has the molecular formula C15H18N2O4S2 and a molecular weight of 354.45 g/mol. Its IUPAC name is 4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide.

Molecular Properties

Compound Name4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide
PubChem CID1309244
Molecular FormulaC15H18N2O4S2
Molecular Weight354.45 g/mol
Exact Mass354.07
IUPAC Name4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide
SMILESCS(=O)(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C15H18N2O4S2/c1-22(18,19)17-14-7-9-15(10-8-14)23(20,21)16-12-11-13-5-3-2-4-6-13/h2-10,16-17H,11-12H2,1H3
InChIKeyPXCZLFVLOSKJQN-UHFFFAOYSA-N
XLogP1.58
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide?
The IUPAC name of 4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide (CID 1309244) is 4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide.
What is the SMILES notation for 4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide?
The canonical SMILES for 4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide is CS(=O)(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1.
What is the InChIKey of 4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide?
The InChIKey is PXCZLFVLOSKJQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4S2/c1-22(18,19)17-14-7-9-15(10-8-14)23(20,21)16-12-11-13-5-3-2-4-6-13/h2-10,16-17H,11-12H2,1H3.
What are the key properties of 4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide?
4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide has a molecular weight of 354.45 g/mol, XLogP of 1.58, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methanesulfonamido)-N-(2-phenylethyl)benzenesulfonamide is sourced from PubChem (CID 1309244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).