Cas no 1443-97-6 (Benzenesulfonamide,N-[[(hexahydro-1H-azepin-1-yl)amino]carbonyl]-)
![Benzenesulfonamide,N-[[(hexahydro-1H-azepin-1-yl)amino]carbonyl]- structure](https://ossimg.kuujia.com/scimg/1500/1443-97-6x500.png)
1443-97-6 structure
Product Name:Benzenesulfonamide,N-[[(hexahydro-1H-azepin-1-yl)amino]carbonyl]-
CAS No:1443-97-6
MF:C13H19N3O3S
MW:297.37326169014
CID:164483
PubChem ID:15045
Update Time:2025-04-19
Benzenesulfonamide,N-[[(hexahydro-1H-azepin-1-yl)amino]carbonyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonamide,N-[[(hexahydro-1H-azepin-1-yl)amino]carbonyl]-
- 1-(Hexahydro-1H-azepin-1-yl)-3-(phenyl sulfonyl)urea
- Benzenesulfonamide, N-(((hexahydro-1H-azepin-1-yl)amino)carbonyl)-
- UNII-BF0RJC933R
- BF0RJC933R
- 1443-97-6
- Urea, 1-(hexahydro-1H-azepin-1-yl)-3-(phenylsulfonyl)-
-
- Inchi： 1S/C13H19N3O3S/c17-13(14-16-10-6-1-2-7-11-16)15-20(18,19)12-8-4-3-5-9-12/h3-5,8-9H,1-2,6-7,10-11H2,(H2,14,15,17)
- InChI Key： NZDKMBBIDFIQEZ-UHFFFAOYSA-N
- SMILES： S(C1C=CC=CC=1)(NC(NN1CCCCCC1)=O)(=O)=O
Computed Properties
- Exact Mass: 297.11487
- Monoisotopic Mass: 297.114712
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 3
- Complexity: 405
- 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: 1
- Topological Polar Surface Area: 86.9
Experimental Properties
- Density: 1.32
- Refractive Index: 1.603
- PSA: 78.51
Benzenesulfonamide,N-[[(hexahydro-1H-azepin-1-yl)amino]carbonyl]- Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Jason Wan Lab Chip, 2020,20, 4528-4538
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