(E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid
TL;DR: (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid (CAS 6306-45-2) is a chemical compound with molecular formula C5H5Br2N3O3 and molecular weight 312.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid
Also Known As: 2,3-dibromo-4-semicarbazono-crotonic acid
| Molecular Formula | C5H5Br2N3O3 |
|---|---|
| Molecular Weight | 312.87 g/mol |
| LogP | 0.7265 |
| Topological Polar Surface Area | 104.78 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.86978 |
| Heavy Atoms | 13 |
| Complexity | 286.7492 |
Chemical Identifiers
| CAS Number | 6306-45-2 |
|---|---|
| SMILES | C(=N/NC(=O)N)\C(=C(\C(=O)O)/Br)\Br |
Product Overview
(E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid (CAS 6306-45-2), with molecular formula C5H5Br2N3O3 and molecular weight 312.87 g/mol. IUPAC: (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid.
Chemical Property Profile of (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid
Property Insights of (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid
The XLogP value of 0.7265 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid. The TPSA of 104.78 Ų falls within the moderate polarity range, balancing permeability and solubility for (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid. Following Lipinski's Rule of Five, (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid 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
Frequently Asked Questions
What is the CAS number of (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid?
The CAS number of (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid is 6306-45-2.
What is the molecular formula of (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid?
The molecular formula of (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid is C5H5Br2N3O3.
What is the molecular weight of (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid?
The molecular weight of (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid is 312.87 g/mol.
Where can I buy (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid?
You can request a quote for (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for (E,4E)-2,3-dibromo-4-(carbamoylhydrazinylidene)but-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.