Cas no 29579-66-6 (1,5-Diazacycloheneicosane-6,14-dione,5-(4-aminobutyl)-)
29579-66-6 structure
Product Name:1,5-Diazacycloheneicosane-6,14-dione,5-(4-aminobutyl)-
CAS No:29579-66-6
MF:C23H45N3O2
MW:395.622306585312
CID:265098
PubChem ID:15215099
Update Time:2025-04-19
1,5-Diazacycloheneicosane-6,14-dione,5-(4-aminobutyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1,5-Diazacycloheneicosane-6,14-dione,5-(4-aminobutyl)-
- Inandenin-13-one
- InandeninB
- Inandenine B
- 29579-66-6
- 5-(4-AMINOBUTYL)-1,5-DIAZACYCLOHENICOSANE-6,14-DIONE
-
- Inchi: 1S/C23H45N3O2/c24-17-10-12-20-26-21-13-19-25-18-11-6-2-4-8-15-22(27)14-7-3-1-5-9-16-23(26)28/h25H,1-21,24H2
- InChI Key: AEAOJRNQWFGMNK-UHFFFAOYSA-N
- SMILES: O=C1CCCCCCCC(CCCCCCCNCCCN1CCCCN)=O
Computed Properties
- Exact Mass: 395.35117769g/mol
- Monoisotopic Mass: 395.35117769g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 28
- Rotatable Bond Count: 4
- Complexity: 401
- 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: 3.3
- Topological Polar Surface Area: 75.4?2
1,5-Diazacycloheneicosane-6,14-dione,5-(4-aminobutyl)- Related Literature
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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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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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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