4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide

C23H21N3O3S — CID 58615628

IUPAC4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1
InChIInChI=1S/C23H21N3O3S/c27-23(26-19-6-2-1-3-7-19)17-10-12-20(13-11-17)30(28,29)25-15-14-18-16-24-22-9-5-4-8-21(18)22/h1-13,16,24-25H,14-15H2,(H,26,27)
InChIKeyFQJIBMNSLBAYBD-UHFFFAOYSA-N
MW419.51 g/mol
LogP3.94
Rot. Bonds7

About 4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide

4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide (PubChem CID 58615628) has the molecular formula C23H21N3O3S and a molecular weight of 419.51 g/mol. Its IUPAC name is 4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide.

Molecular Properties

Compound Name4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide
PubChem CID58615628
Molecular FormulaC23H21N3O3S
Molecular Weight419.51 g/mol
Exact Mass419.13
IUPAC Name4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1
InChIInChI=1S/C23H21N3O3S/c27-23(26-19-6-2-1-3-7-19)17-10-12-20(13-11-17)30(28,29)25-15-14-18-16-24-22-9-5-4-8-21(18)22/h1-13,16,24-25H,14-15H2,(H,26,27)
InChIKeyFQJIBMNSLBAYBD-UHFFFAOYSA-N
XLogP3.94
TPSA91.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.51
LogP ≤ 53.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide 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-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide
CID 109058300
4-(bromomethyl)-N-[2-(1H-indol-3-yl)ethyl]benzenesulfonamide
CID 2737664
3-(benzenesulfonamido)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 27644763
4-[2-(4-fluorophenyl)ethylsulfamoyl]-N-phenylbenzamide
CID 109061048
4-[2-(1H-indol-3-yl)ethylamino]-N-pyridin-4-ylbenzamide
CID 59555813
1-N,4-N-bis[2-(1H-indol-3-yl)ethyl]benzene-1,4-dicarboxamide
CID 42988811
3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 18107802
N-tert-butyl-3-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide
CID 109065045
4-(dimethylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 27645316
1-[2-(1H-indol-3-yl)ethyl]-3-(4-sulfamoylphenyl)urea
CID 24650587
N-[2-(1H-indol-3-yl)ethyl]-2,3-dioxo-1,4-dihydroquinoxaline-6-sulfonamide
CID 25039281
4-(ethylsulfamoyl)-N-phenylbenzamide
CID 1262046

Frequently Asked Questions

What is the IUPAC name of 4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide?
The IUPAC name of 4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide (CID 58615628) is 4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide.
What is the SMILES notation for 4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide?
The canonical SMILES for 4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide is O=C(Nc1ccccc1)c1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1.
What is the InChIKey of 4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide?
The InChIKey is FQJIBMNSLBAYBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O3S/c27-23(26-19-6-2-1-3-7-19)17-10-12-20(13-11-17)30(28,29)25-15-14-18-16-24-22-9-5-4-8-21(18)22/h1-13,16,24-25H,14-15H2,(H,26,27).
What are the key properties of 4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide?
4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide has a molecular weight of 419.51 g/mol, XLogP of 3.94, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide is sourced from PubChem (CID 58615628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).