N-[3-(benzenesulfonamido)phenyl]-2-benzhydryloxyacetamide

C27H24N2O4S — CID 55721516

IUPACN-[3-(benzenesulfonamido)phenyl]-2-benzhydryloxyacetamide
SMILESO=C(COC(c1ccccc1)c1ccccc1)Nc1cccc(NS(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C27H24N2O4S/c30-26(20-33-27(21-11-4-1-5-12-21)22-13-6-2-7-14-22)28-23-15-10-16-24(19-23)29-34(31,32)25-17-8-3-9-18-25/h1-19,27,29H,20H2,(H,28,30)
InChIKeyXIGIBIXELFHINL-UHFFFAOYSA-N
MW472.57 g/mol
LogP5.23
Rot. Bonds9

About N-[3-(benzenesulfonamido)phenyl]-2-benzhydryloxyacetamide

N-[3-(benzenesulfonamido)phenyl]-2-benzhydryloxyacetamide (PubChem CID 55721516) has the molecular formula C27H24N2O4S and a molecular weight of 472.57 g/mol. Its IUPAC name is N-[3-(benzenesulfonamido)phenyl]-2-benzhydryloxyacetamide.

Molecular Properties

Compound NameN-[3-(benzenesulfonamido)phenyl]-2-benzhydryloxyacetamide
PubChem CID55721516
Molecular FormulaC27H24N2O4S
Molecular Weight472.57 g/mol
Exact Mass472.15
IUPAC NameN-[3-(benzenesulfonamido)phenyl]-2-benzhydryloxyacetamide
SMILESO=C(COC(c1ccccc1)c1ccccc1)Nc1cccc(NS(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C27H24N2O4S/c30-26(20-33-27(21-11-4-1-5-12-21)22-13-6-2-7-14-22)28-23-15-10-16-24(19-23)29-34(31,32)25-17-8-3-9-18-25/h1-19,27,29H,20H2,(H,28,30)
InChIKeyXIGIBIXELFHINL-UHFFFAOYSA-N
XLogP5.23
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500472.57
LogP ≤ 55.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-[3-[(4-methylphenyl)sulfonylamino]phenyl]acetamide
CID 35545961
2-methoxy-N-[3-[(4-methylsulfonylphenyl)sulfonylamino]phenyl]acetamide
CID 25335006
N-[3-(benzenesulfonamido)phenyl]-4-phenylbutanamide
CID 55706016
N-[3-(benzenesulfonamido)phenyl]-3-(2-hydroxyphenyl)propanamide
CID 55721517
2-[3-(benzenesulfonamido)anilino]-N-pyridin-4-ylacetamide
CID 23206275
2-benzhydryloxy-N-[4-(sulfamoylmethyl)phenyl]acetamide
CID 55552074
N-[3-(benzenesulfonamido)phenyl]-2-(2-oxochromen-7-yl)oxyacetamide
CID 46465678
N-[3-(benzenesulfonamido)phenyl]-4-(2-bromophenoxy)butanamide
CID 55840132
N-[3-(1-hydroxypropyl)phenyl]benzenesulfonamide
CID 174636480
[2-[[3-(benzenesulfonamido)phenyl]carbamoylamino]-3-carboxypropyl]-trimethylazanium
CID 74424924
N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]-2-phenoxyacetamide
CID 26592931
2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]acetamide
CID 5157338

Frequently Asked Questions

What is the IUPAC name of N-[3-(benzenesulfonamido)phenyl]-2-benzhydryloxyacetamide?
The IUPAC name of N-[3-(benzenesulfonamido)phenyl]-2-benzhydryloxyacetamide (CID 55721516) is N-[3-(benzenesulfonamido)phenyl]-2-benzhydryloxyacetamide.
What is the SMILES notation for N-[3-(benzenesulfonamido)phenyl]-2-benzhydryloxyacetamide?
The canonical SMILES for N-[3-(benzenesulfonamido)phenyl]-2-benzhydryloxyacetamide is O=C(COC(c1ccccc1)c1ccccc1)Nc1cccc(NS(=O)(=O)c2ccccc2)c1.
What is the InChIKey of N-[3-(benzenesulfonamido)phenyl]-2-benzhydryloxyacetamide?
The InChIKey is XIGIBIXELFHINL-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24N2O4S/c30-26(20-33-27(21-11-4-1-5-12-21)22-13-6-2-7-14-22)28-23-15-10-16-24(19-23)29-34(31,32)25-17-8-3-9-18-25/h1-19,27,29H,20H2,(H,28,30).
What are the key properties of N-[3-(benzenesulfonamido)phenyl]-2-benzhydryloxyacetamide?
N-[3-(benzenesulfonamido)phenyl]-2-benzhydryloxyacetamide has a molecular weight of 472.57 g/mol, XLogP of 5.23, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(benzenesulfonamido)phenyl]-2-benzhydryloxyacetamide is sourced from PubChem (CID 55721516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).