Cas no 915404-83-0 (Pyrimido[1,2-a][1,3]diazepine, 1,2,3,4,6,7,8,9-octahydro-)
![Pyrimido[1,2-a][1,3]diazepine, 1,2,3,4,6,7,8,9-octahydro- structure](https://ossimg.kuujia.com/scimg/915500/915404-83-0x500.png)
915404-83-0 structure
Product Name:Pyrimido[1,2-a][1,3]diazepine, 1,2,3,4,6,7,8,9-octahydro-
CAS No:915404-83-0
MF:C8H15N3
MW:153.224801301956
CID:748607
PubChem ID:68901773
Update Time:2025-04-19
Pyrimido[1,2-a][1,3]diazepine, 1,2,3,4,6,7,8,9-octahydro- Chemical and Physical Properties
Names and Identifiers
-
- Pyrimido[1,2-a][1,3]diazepine, 1,2,3,4,6,7,8,9-octahydro-
- 2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a][1,3]diazepine
- SCHEMBL4073814
- 915404-83-0
- SCHEMBL12983671
- DTXSID50739212
-
- Inchi： 1S/C8H15N3/c1-2-6-11-7-3-5-10-8(11)9-4-1/h1-7H2,(H,9,10)
- InChI Key： JHVLQAGCPSFDPC-UHFFFAOYSA-N
- SMILES： N12C(=NCCC1)NCCCC2
Computed Properties
- Exact Mass: 153.126597491g/mol
- Monoisotopic Mass: 153.126597491g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 165
- 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: 0.1
- Topological Polar Surface Area: 27.6?2
Pyrimido[1,2-a][1,3]diazepine, 1,2,3,4,6,7,8,9-octahydro- Related Literature
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1. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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