Cas no 34352-60-8 (5H-Pyridazino[3,4-b][1,4]benzoxazine, 5-methyl-3-(1-piperazinyl)-)
34352-60-8 structure
Product Name:5H-Pyridazino[3,4-b][1,4]benzoxazine, 5-methyl-3-(1-piperazinyl)-
CAS No:34352-60-8
MF:C15H17N5O
MW:283.328382253647
CID:323491
PubChem ID:214832
Update Time:2025-04-19
5H-Pyridazino[3,4-b][1,4]benzoxazine, 5-methyl-3-(1-piperazinyl)- Chemical and Physical Properties
Names and Identifiers
-
- 5H-Pyridazino[3,4-b][1,4]benzoxazine, 5-methyl-3-(1-piperazinyl)-
- 5-methyl-3-piperazin-1-ylpyridazino[3,4-b][1,4]benzoxazine
- 34352-60-8
- 5-Methyl-3-(1-piperazinyl)-5H-pyridazino(3,4-b)(1,4)benzoxazine
- 5-Methyl-3-(piperazin-1-yl)-5H-benzo[b]pyridazino[4,3-e][1,4]oxazine
- DTXSID80187929
- 5H-Pyridazino(3,4-b)(1,4)benzoxazine, 5-methyl-3-(1-piperazinyl)-
-
- Inchi: 1S/C15H17N5O/c1-19-11-4-2-3-5-13(11)21-15-12(19)10-14(17-18-15)20-8-6-16-7-9-20/h2-5,10,16H,6-9H2,1H3
- InChI Key: KMKHHMJOWLXRHH-UHFFFAOYSA-N
- SMILES: O1C2C=CC=CC=2N(C)C2C1=NN=C(C=2)N1CCNCC1
Computed Properties
- Exact Mass: 283.14351
- Monoisotopic Mass: 283.143
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 21
- Rotatable Bond Count: 1
- Complexity: 362
- 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: 1.3
- Topological Polar Surface Area: 53.5?2
Experimental Properties
- Density: 1.271
- Boiling Point: 558.6°Cat760mmHg
- Flash Point: 291.6°C
- Refractive Index: 1.624
- PSA: 53.52
5H-Pyridazino[3,4-b][1,4]benzoxazine, 5-methyl-3-(1-piperazinyl)- Related Literature
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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