![Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate structure](/static/products/6450/64500-30-7.webp)
Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate
TL;DR: Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate (CAS 64500-30-7) is a chemical compound with molecular formula C11H12Br2N2O2 and molecular weight 361.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate
Also Known As: ethyl 3-[(3,5-dibromopyridin-2-yl)amino]but-2-enoate, ethyl (E)-3-[(3,5-dibromopyridin-2-yl)amino]but-2-enoate
| Molecular Formula | C11H12Br2N2O2 |
|---|---|
| Molecular Weight | 361.93 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 361.92654 |
| Heavy Atoms | 17 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 64500-30-7 |
|---|---|
| SMILES | CCOC(=O)C=C(C)NC1=C(C=C(C=N1)Br)Br |
| InChIKey | VDORKXVSZFTKFY-UHFFFAOYSA-N |
Product Overview
Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate (CAS 64500-30-7), with molecular formula C11H12Br2N2O2 and molecular weight 361.93 g/mol. IUPAC: ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate.
Chemical Property Profile of Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate
Property Insights of Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate
The XLogP value of 3.8 indicates that Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate?
The CAS number of Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate is 64500-30-7.
What is the molecular formula of Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate?
The molecular formula of Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate is C11H12Br2N2O2.
What is the molecular weight of Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate?
The molecular weight of Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate is 361.93 g/mol.
Where can I buy Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate?
You can request a quote for Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-[(3,5-dibromo-2-pyridinyl)amino]but-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.