Carcinine
TL;DR: Carcinine (CAS 56897-53-1) is a chemical compound with molecular formula C8H14N4O and molecular weight 182.11676 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-amino-N-[2-(1H-imidazol-5-yl)ethyl]propanamide
Also Known As: Carcinine, beta-Alanylhistamine, Alistin, N-(2-(1H-Imidazol-5-yl)ethyl)-3-aminopropanamide, Carcinine ditrifluoroacetate
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H14N4O |
| Molecular Weight | 182.11676 g/mol |
| XLogP | -1.5 |
| Topological Polar Surface Area (TPSA) | 83.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 182.11676 Da |
| Heavy Atoms | 13 |
| Complexity | 162.0 |
| SMILES | C1=C(NC=N1)CCNC(=O)CCN |
| InChIKey | ANRUJJLGVODXIK-UHFFFAOYSA-N |
Product Description
Applications: Carcinine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Carcinine (CAS 56897-53-1) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A pharmaceutical intermediate supplied by CoreyChem, Carcinine (CAS 56897-53-1) has the molecular formula C8H14N4O and a molecular weight of 182.12 g/mol. It is also known as Carcinine and beta-Alanylhistamine.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Carcinine
Property Insights of Carcinine
The XLogP value of -1.5 indicates that Carcinine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Carcinine. Following Lipinski's Rule of Five, Carcinine has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Carcinine?
The CAS number of Carcinine is 56897-53-1.
What is the molecular formula of Carcinine?
The molecular formula of Carcinine is C8H14N4O.
What is the molecular weight of Carcinine?
The molecular weight of Carcinine is 182.11676 g/mol.
What are the applications of Carcinine?
Carcinine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Carcinine (CAS 56897-53-1) with custom...
Where can I buy Carcinine?
You can request a quote for Carcinine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carcinine?
Yes, CoreyChem provides custom synthesis services for Carcinine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.