Cas no 65094-31-7 (1,5,9-Triazacyclotridec-12-en-2-one, 9-[(2E)-1-oxo-3-phenyl-2-propen-1-yl]-4-phenyl-, (4S,12Z)-)
![1,5,9-Triazacyclotridec-12-en-2-one, 9-[(2E)-1-oxo-3-phenyl-2-propen-1-yl]-4-phenyl-, (4S,12Z)- structure](https://ossimg.kuujia.com/scimg/65500/65094-31-7x500.png)
65094-31-7 structure
Product Name:1,5,9-Triazacyclotridec-12-en-2-one, 9-[(2E)-1-oxo-3-phenyl-2-propen-1-yl]-4-phenyl-, (4S,12Z)-
CAS No:65094-31-7
MF:C25H29N3O2
MW:403.517598756895
CID:515641
Update Time:2024-03-01
1,5,9-Triazacyclotridec-12-en-2-one, 9-[(2E)-1-oxo-3-phenyl-2-propen-1-yl]-4-phenyl-, (4S,12Z)- Chemical and Physical Properties
Names and Identifiers
-
- 1,5,9-Triazacyclotridec-12-en-2-one,9-[(2E)-1-oxo-3-phenyl-2-propen-1-yl]-4-phenyl-, (4S,12Z)-
- 1,5,9-Triazacyclotridec-12-en-2-one,9-[(2E)-1-oxo-3-phenyl-2-propenyl]-4-phenyl-, (4S,12Z)- (9CI)
- Neoperiphylline
- 1,5,9-Triazacyclotridec-12-en-2-one, 9-[(2E)-1-oxo-3-phenyl-2-propen-1-yl]-4-phenyl-, (4S,12Z)-
-
- Inchi： 1S/C25H29N3O2/c29-24-20-23(22-12-5-2-6-13-22)26-17-9-19-28(18-8-7-16-27-24)25(30)15-14-21-10-3-1-4-11-21/h1-7,10-16,23,26H,8-9,17-20H2,(H,27,29)/b15-14+,16-7-/t23-/m0/s1
- InChI Key： AORCSZCLPCSPAQ-XCSWJPGLSA-N
- SMILES： N1C=CCCN(C(=O)/C=C/C2=CC=CC=C2)CCCN[C@H](C2=CC=CC=C2)CC1=O |c:1|
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 30
- XLogP3: 2.702
1,5,9-Triazacyclotridec-12-en-2-one, 9-[(2E)-1-oxo-3-phenyl-2-propen-1-yl]-4-phenyl-, (4S,12Z)- Related Literature
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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4. An investigation of the electrochemical delithiation process of carbon coated α-Fe2O3nanoparticlesAdrian Brandt,Florian Winter,Sebastian Klamor,Frank Berkemeier,Jatinkumar Rana,Rainer P?ttgen,Andrea Balducci J. Mater. Chem. A, 2013,1, 11229-11236
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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