N-(5-acetamido-2-methoxyphenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide

C24H23N3O5S — CID 4849615

IUPACN-(5-acetamido-2-methoxyphenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1
InChIInChI=1S/C24H23N3O5S/c1-16(28)25-19-10-11-23(32-2)21(15-19)26-24(29)18-7-5-8-20(14-18)33(30,31)27-13-12-17-6-3-4-9-22(17)27/h3-11,14-15H,12-13H2,1-2H3,(H,25,28)(H,26,29)
InChIKeyWUAYQKWLQUYMNB-UHFFFAOYSA-N
MW465.53 g/mol
LogP3.66
Rot. Bonds6

About N-(5-acetamido-2-methoxyphenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide

N-(5-acetamido-2-methoxyphenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide (PubChem CID 4849615) has the molecular formula C24H23N3O5S and a molecular weight of 465.53 g/mol. Its IUPAC name is N-(5-acetamido-2-methoxyphenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide.

Molecular Properties

Compound NameN-(5-acetamido-2-methoxyphenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide
PubChem CID4849615
Molecular FormulaC24H23N3O5S
Molecular Weight465.53 g/mol
Exact Mass465.14
IUPAC NameN-(5-acetamido-2-methoxyphenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1
InChIInChI=1S/C24H23N3O5S/c1-16(28)25-19-10-11-23(32-2)21(15-19)26-24(29)18-7-5-8-20(14-18)33(30,31)27-13-12-17-6-3-4-9-22(17)27/h3-11,14-15H,12-13H2,1-2H3,(H,25,28)(H,26,29)
InChIKeyWUAYQKWLQUYMNB-UHFFFAOYSA-N
XLogP3.66
TPSA104.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500465.53
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide
CID 2083341
4-fluoro-N-[1-(4-methoxyphenyl)sulfonyl-2,3-dihydroindol-7-yl]benzamide
CID 24993214
N-[1-(4-methoxy-benzenesulfonyl)-2,3-dihydro-1H-indol-7-yl]-benzamide
CID 25168005
N-(3-(4-fluorophenylsulfonamido)-4-methoxyphenyl)-[1,1'-biphenyl]-4-carboxamide
CID 5020799
2-[6-[4-(2-Methoxyphenyl)piperazin-1-yl]hexyl]-1,1-dioxo-1,2-benzothiazol-3-one
CID 155554326
3-(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)-N-(2-methoxyphenyl)propanamide
CID 1317129
N-(2-ethoxyphenyl)-6-morpholin-4-ylsulfonyl-2-oxo-1H-quinoline-4-carboxamide
CID 2463208
[3-(2,3-Dihydroindol-1-ylsulfonyl)phenyl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
CID 2492468
4-[(2-methoxyphenyl)sulfamoyl]-N-[(4-sulfamoylphenyl)methyl]benzamide
CID 2519306
3-[(2-methoxy-5-nitrophenyl)sulfamoyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide
CID 4830546
N-(2-methoxyphenyl)-2-[(1-pyrrolidinylsulfonyl)amino]benzamide
CID 1252535
2-[3-(Diethylsulfamoyl)benzamido]-N-(4-methoxyphenyl)benzamide
CID 4651552

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methoxyphenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide?
The IUPAC name of N-(5-acetamido-2-methoxyphenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide (CID 4849615) is N-(5-acetamido-2-methoxyphenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide.
What is the SMILES notation for N-(5-acetamido-2-methoxyphenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide?
The canonical SMILES for N-(5-acetamido-2-methoxyphenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide is COc1ccc(NC(C)=O)cc1NC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1.
What is the InChIKey of N-(5-acetamido-2-methoxyphenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide?
The InChIKey is WUAYQKWLQUYMNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O5S/c1-16(28)25-19-10-11-23(32-2)21(15-19)26-24(29)18-7-5-8-20(14-18)33(30,31)27-13-12-17-6-3-4-9-22(17)27/h3-11,14-15H,12-13H2,1-2H3,(H,25,28)(H,26,29).
What are the key properties of N-(5-acetamido-2-methoxyphenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide?
N-(5-acetamido-2-methoxyphenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide has a molecular weight of 465.53 g/mol, XLogP of 3.66, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methoxyphenyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide is sourced from PubChem (CID 4849615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).