Cas no 603965-77-1 (Ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate)
Ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate is a versatile heterocyclic compound featuring a pyrimidine core substituted with a piperazine moiety and an ethyl ester group. This structure imparts significant reactivity, making it a valuable intermediate in pharmaceutical and agrochemical synthesis. The piperazine ring enhances solubility and bioavailability, while the ester group offers flexibility for further functionalization. Its well-defined chemical properties facilitate precise modifications, enabling applications in drug discovery, particularly for kinase inhibitors and CNS-targeting agents. The compound’s stability under standard conditions ensures reliable handling and storage. Its synthetic utility and structural features make it a preferred choice for researchers developing novel bioactive molecules.
603965-77-1 structure
Product Name:Ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate
CAS No:603965-77-1
MF:C11H16N4O2
MW:236.270341873169
CID:843817
PubChem ID:11253343
Update Time:2025-05-20
Ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- Ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate
- 5-Pyrimidinecarboxylic acid, 2-(1-piperazinyl)-, ethyl ester
- ethyl 2-piperazin-1-ylpyrimidine-5-carboxylate
- DTXSID60460202
- F88046
- SCHEMBL386644
- CS-0298972
- EN300-13320230
- DA-34396
- 603965-77-1
-
- Inchi： 1S/C11H16N4O2/c1-2-17-10(16)9-7-13-11(14-8-9)15-5-3-12-4-6-15/h7-8,12H,2-6H2,1H3
- InChI Key： WGCSHLUYKRADNA-UHFFFAOYSA-N
- SMILES： O(CC)C(C1C=NC(=NC=1)N1CCNCC1)=O
Computed Properties
- Exact Mass: 236.12748
- Monoisotopic Mass: 236.12732577g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 248
- 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: 0.2
- Topological Polar Surface Area: 67.4?2
Experimental Properties
- Density: 1.189
- Boiling Point: 407.2°C at 760 mmHg
- Flash Point: 200.1°C
- Refractive Index: 1.54
- PSA: 67.35
Ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM164882-1g |
ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate |
603965-77-1 | 95% | 1g |
$1828 | 2021-08-05 | |
| Chemenu | CM164882-1g |
ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate |
603965-77-1 | 95% | 1g |
$*** | 2023-05-30 | |
| Enamine | EN300-13320230-0.05g |
ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate |
603965-77-1 | 0.05g |
$563.0 | 2023-05-25 | ||
| Enamine | EN300-13320230-0.1g |
ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate |
603965-77-1 | 0.1g |
$591.0 | 2023-05-25 | ||
| Enamine | EN300-13320230-0.25g |
ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate |
603965-77-1 | 0.25g |
$617.0 | 2023-05-25 | ||
| Enamine | EN300-13320230-0.5g |
ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate |
603965-77-1 | 0.5g |
$645.0 | 2023-05-25 | ||
| Enamine | EN300-13320230-1.0g |
ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate |
603965-77-1 | 1g |
$671.0 | 2023-05-25 | ||
| Enamine | EN300-13320230-2.5g |
ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate |
603965-77-1 | 2.5g |
$1315.0 | 2023-05-25 | ||
| Enamine | EN300-13320230-5.0g |
ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate |
603965-77-1 | 5g |
$1945.0 | 2023-05-25 | ||
| Enamine | EN300-13320230-10.0g |
ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate |
603965-77-1 | 10g |
$2884.0 | 2023-05-25 |
Ethyl 2-(piperazin-1-yl)pyrimidine-5-carboxylate Related Literature
-
Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
-
Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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