Cas no 62564-05-0 (Benzenesulfonamide, 4-amino-2-methoxy-N-[2-(4-morpholinyl)ethyl]-)
62564-05-0 structure
Product Name:Benzenesulfonamide, 4-amino-2-methoxy-N-[2-(4-morpholinyl)ethyl]-
CAS No:62564-05-0
MF:C13H21N3O4S
MW:315.388541936874
CID:440106
PubChem ID:43257746
Update Time:2025-04-19
Benzenesulfonamide, 4-amino-2-methoxy-N-[2-(4-morpholinyl)ethyl]- Chemical and Physical Properties
Names and Identifiers
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- Benzenesulfonamide, 4-amino-2-methoxy-N-[2-(4-morpholinyl)ethyl]-
- 4-amino-2-methoxy-N-(2-morpholin-4-ylethyl)benzenesulfonamide
- 62564-05-0
- DTXSID00655791
- 4-Amino-2-methoxy-N-[2-(morpholin-4-yl)ethyl]benzene-1-sulfonamide
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- Inchi: 1S/C13H21N3O4S/c1-19-12-10-11(14)2-3-13(12)21(17,18)15-4-5-16-6-8-20-9-7-16/h2-3,10,15H,4-9,14H2,1H3
- InChI Key: DYJNQBIXXXWPNI-UHFFFAOYSA-N
- SMILES: S(C1C=CC(=CC=1OC)N)(NCCN1CCOCC1)(=O)=O
Computed Properties
- Exact Mass: 315.12543
- Monoisotopic Mass: 315.125
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 21
- Rotatable Bond Count: 6
- Complexity: 406
- 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
- Topological Polar Surface Area: 102A^2
- XLogP3: -0.2
Experimental Properties
- PSA: 93.89
Benzenesulfonamide, 4-amino-2-methoxy-N-[2-(4-morpholinyl)ethyl]- Related Literature
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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