Cas no 128550-00-5 (1H-Indole-3-acetamide,N-[3-[[3-[[4-[(3-aminopropyl)amino]butyl]amino]propyl]hydroxyamino]propyl]-4-hydroxy-)
![1H-Indole-3-acetamide,N-[3-[[3-[[4-[(3-aminopropyl)amino]butyl]amino]propyl]hydroxyamino]propyl]-4-hydroxy- structure](https://ossimg.kuujia.com/scimg/129000/128550-00-5x500.png)
128550-00-5 structure
Product Name:1H-Indole-3-acetamide,N-[3-[[3-[[4-[(3-aminopropyl)amino]butyl]amino]propyl]hydroxyamino]propyl]-4-hydroxy-
CAS No:128550-00-5
MF:C23H40N6O3
MW:448.602105140686
CID:207336
PubChem ID:182911
Update Time:2025-04-19
1H-Indole-3-acetamide,N-[3-[[3-[[4-[(3-aminopropyl)amino]butyl]amino]propyl]hydroxyamino]propyl]-4-hydroxy- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole-3-acetamide,N-[3-[[3-[[4-[(3-aminopropyl)amino]butyl]amino]propyl]hydroxyamino]propyl]-4-hydroxy-
- N-[3-[3-[4-(3-aminopropylamino)butylamino]propyl-hydroxyamino]propyl]-2-(4-hydroxy-1H-indol-3-yl)acetamide
- Agelenotoxin 448
- Agel 448
- 128550-00-5
- DTXSID20155925
-
- Inchi： 1S/C23H40N6O3/c24-9-4-12-25-10-1-2-11-26-13-5-15-29(32)16-6-14-27-22(31)17-19-18-28-20-7-3-8-21(30)23(19)20/h3,7-8,18,25-26,28,30,32H,1-2,4-6,9-17,24H2,(H,27,31)
- InChI Key： FSGGDDPNTYEPDY-UHFFFAOYSA-N
- SMILES： ON(CCCNC(CC1=CNC2C=CC=C(C1=2)O)=O)CCCNCCCCNCCCN
Computed Properties
- Exact Mass: 447.30867
- Monoisotopic Mass: 448.31618916g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 7
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 32
- Rotatable Bond Count: 18
- Complexity: 498
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.4
- Topological Polar Surface Area: 139?2
Experimental Properties
- PSA: 135.77
1H-Indole-3-acetamide,N-[3-[[3-[[4-[(3-aminopropyl)amino]butyl]amino]propyl]hydroxyamino]propyl]-4-hydroxy- Related Literature
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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