Cas no 173850-51-6 (1-(5-methylisoxazol-3-yl)methylpiperazine)
1-(5-Methylisoxazol-3-yl)methylpiperazine is a heterocyclic compound featuring a piperazine core linked to a 5-methylisoxazole moiety via a methylene bridge. This structure imparts versatility in pharmaceutical and agrochemical applications, particularly as a key intermediate in the synthesis of bioactive molecules. Its isoxazole ring contributes to enhanced metabolic stability and binding affinity, while the piperazine group offers flexibility for further functionalization. The compound is valued for its potential in developing CNS-targeting agents, antimicrobials, or kinase inhibitors due to its balanced lipophilicity and hydrogen-bonding capacity. High-purity grades are available for research applications, ensuring reproducibility in synthetic pathways. Proper handling under inert conditions is recommended due to potential sensitivity.
173850-51-6 structure
Product Name:1-(5-methylisoxazol-3-yl)methylpiperazine
CAS No:173850-51-6
MF:C9H15N3O
MW:181.234901666641
CID:905960
PubChem ID:4962490
Update Time:2025-06-07
1-(5-methylisoxazol-3-yl)methylpiperazine Chemical and Physical Properties
Names and Identifiers
-
- Piperazine, 1-[(5-methyl-3-isoxazolyl)methyl]- (9CI)
- 1-[(5-methyl-3-isoxazolyl)methyl]Piperazine
- 5-methyl-3-(piperazin-1-ylmethyl)-1,2-oxazole
- CS-0169029
- Piperazine, 1-[(5-methyl-3-isoxazolyl)methyl]-
- 1-[(5-methylisoxazol-3-yl)methyl]piperazine
- DTXSID10407107
- Z90660989
- 5-Methyl-3-(piperazin-1-ylmethyl)isoxazole
- MFCD06655908
- 1-[(5-methylisoxazol-3-yl)methyl]piperazine, AldrichCPR
- BS-13739
- 173850-51-6
- SCHEMBL1087788
- STK353143
- AKOS000118493
- 1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine
- G56467
- EN300-13527
- WAY-652435
- DA-30088
- J-010947
- 1-(5-methylisoxazol-3-yl)methylpiperazine
-
- Inchi： 1S/C9H15N3O/c1-8-6-9(11-13-8)7-12-4-2-10-3-5-12/h6,10H,2-5,7H2,1H3
- InChI Key： PHLMNRYXLHHLJG-UHFFFAOYSA-N
- SMILES： O1C(C)=CC(CN2CCNCC2)=N1
Computed Properties
- Exact Mass: 181.12165
- Monoisotopic Mass: 181.121512110g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 159
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 0
- Topological Polar Surface Area: 41.3?2
Experimental Properties
- PSA: 41.3
1-(5-methylisoxazol-3-yl)methylpiperazine Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | M593145-10mg |
1-[(5-methylisoxazol-3-yl)methyl]piperazine |
173850-51-6 | 10mg |
$ 50.00 | 2022-06-03 | ||
| TRC | M593145-50mg |
1-[(5-methylisoxazol-3-yl)methyl]piperazine |
173850-51-6 | 50mg |
$ 160.00 | 2022-06-03 | ||
| TRC | M593145-100mg |
1-[(5-methylisoxazol-3-yl)methyl]piperazine |
173850-51-6 | 100mg |
$ 250.00 | 2022-06-03 | ||
| SHANG HAI TAO SHU Biotechnology Co., Ltd. | T8582-1 mg |
1-[(5-methylisoxazol-3-yl)methyl]piperazine |
173850-51-6 | 95.00% | 1mg |
￥1300.00 | 2022-04-26 | |
| SHANG HAI TAO SHU Biotechnology Co., Ltd. | T8582-5 mg |
1-[(5-methylisoxazol-3-yl)methyl]piperazine |
173850-51-6 | 95.00% | 5mg |
￥2927.00 | 2022-04-26 | |
| SHANG HAI TAO SHU Biotechnology Co., Ltd. | T8582-10 mg |
1-[(5-methylisoxazol-3-yl)methyl]piperazine |
173850-51-6 | 95.00% | 10mg |
￥4388.00 | 2022-04-26 | |
| SHANG HAI TAO SHU Biotechnology Co., Ltd. | T8582-25 mg |
1-[(5-methylisoxazol-3-yl)methyl]piperazine |
173850-51-6 | 95.00% | 25mg |
￥7898.00 | 2022-04-26 | |
| Chemenu | CM110642-1g |
1-[(5-methylisoxazol-3-yl)methyl]piperazine |
173850-51-6 | 95% | 1g |
$435 | 2023-03-06 | |
| SHANG HAI TAO SHU Biotechnology Co., Ltd. | T8582-1 mg |
Piperazine, 1-[(5-methyl-3-isoxazolyl)methyl]- (9CI) |
173850-51-6 | 95.00% | 1mg |
￥1300.00 | 2021-09-23 | |
| SHANG HAI TAO SHU Biotechnology Co., Ltd. | T8582-5 mg |
Piperazine, 1-[(5-methyl-3-isoxazolyl)methyl]- (9CI) |
173850-51-6 | 95.00% | 5mg |
￥2927.00 | 2021-09-23 |
1-(5-methylisoxazol-3-yl)methylpiperazine Related Literature
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
-
Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
-
Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
-
Yu Long,Bing Yuan,Jianrui Niu,Xin Tong,Jiantai Ma New J. Chem., 2015,39, 1179-1185
-
Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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