N,N-dibenzylbenzenesulfonamide

C20H19NO2S — CID 3721586

IUPACN,N-dibenzylbenzenesulfonamide
SMILESO=S(=O)(c1ccccc1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C20H19NO2S/c22-24(23,20-14-8-3-9-15-20)21(16-18-10-4-1-5-11-18)17-19-12-6-2-7-13-19/h1-15H,16-17H2
InChIKeyOIAXEHUJJBRCLZ-UHFFFAOYSA-N
MW337.44 g/mol
LogP4.08
Rot. Bonds6

About N,N-dibenzylbenzenesulfonamide

N,N-dibenzylbenzenesulfonamide (PubChem CID 3721586) has the molecular formula C20H19NO2S and a molecular weight of 337.44 g/mol. Its IUPAC name is N,N-dibenzylbenzenesulfonamide.

Molecular Properties

Compound NameN,N-dibenzylbenzenesulfonamide
PubChem CID3721586
Molecular FormulaC20H19NO2S
Molecular Weight337.44 g/mol
Exact Mass337.11
IUPAC NameN,N-dibenzylbenzenesulfonamide
SMILESO=S(=O)(c1ccccc1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C20H19NO2S/c22-24(23,20-14-8-3-9-15-20)21(16-18-10-4-1-5-11-18)17-19-12-6-2-7-13-19/h1-15H,16-17H2
InChIKeyOIAXEHUJJBRCLZ-UHFFFAOYSA-N
XLogP4.08
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.44
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dibenzylbenzenesulfonamide?
The IUPAC name of N,N-dibenzylbenzenesulfonamide (CID 3721586) is N,N-dibenzylbenzenesulfonamide.
What is the SMILES notation for N,N-dibenzylbenzenesulfonamide?
The canonical SMILES for N,N-dibenzylbenzenesulfonamide is O=S(=O)(c1ccccc1)N(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N,N-dibenzylbenzenesulfonamide?
The InChIKey is OIAXEHUJJBRCLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO2S/c22-24(23,20-14-8-3-9-15-20)21(16-18-10-4-1-5-11-18)17-19-12-6-2-7-13-19/h1-15H,16-17H2.
What are the key properties of N,N-dibenzylbenzenesulfonamide?
N,N-dibenzylbenzenesulfonamide has a molecular weight of 337.44 g/mol, XLogP of 4.08, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzylbenzenesulfonamide is sourced from PubChem (CID 3721586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).