2,2-dibromo-N-carbamoyl-2-cyanoacetamide
TL;DR: 2,2-dibromo-N-carbamoyl-2-cyanoacetamide (CAS 93803-53-3) is a chemical compound with molecular formula C4H3Br2N3O2 and molecular weight 282.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dibromo-N-carbamoyl-2-cyanoacetamide
Also Known As: 2,2-Dibromo-N-carbamoyl-2-cyanoacetamide, EINECS 298-319-5, (2,2-dibromo-2-cyanoacetyl)urea, N-(Aminocarbonyl)-2,2-dibromo-2-cyanoacetamide, ACETAMIDE, N-(AMINOCARBONYL)-2,2-DIBROMO-2-CYANO-
| Molecular Formula | C4H3Br2N3O2 |
|---|---|
| Molecular Weight | 282.86 g/mol |
| LogP | 0.19098 |
| Topological Polar Surface Area | 95.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 282.8592 |
| Heavy Atoms | 11 |
| Complexity | 231.98189 |
Chemical Identifiers
| CAS Number | 93803-53-3 |
|---|---|
| SMILES | C(#N)C(C(=O)NC(=O)N)(Br)Br |
Product Overview
2,2-dibromo-N-carbamoyl-2-cyanoacetamide (CAS 93803-53-3), with molecular formula C4H3Br2N3O2 and molecular weight 282.86 g/mol. IUPAC: 2,2-dibromo-N-carbamoyl-2-cyanoacetamide.
Chemical Property Profile of 2,2-dibromo-N-carbamoyl-2-cyanoacetamide
Property Insights of 2,2-dibromo-N-carbamoyl-2-cyanoacetamide
The XLogP value of 0.19098 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-dibromo-N-carbamoyl-2-cyanoacetamide. The TPSA of 95.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-dibromo-N-carbamoyl-2-cyanoacetamide. Following Lipinski's Rule of Five, 2,2-dibromo-N-carbamoyl-2-cyanoacetamide has 2 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 2,2-dibromo-N-carbamoyl-2-cyanoacetamide?
The CAS number of 2,2-dibromo-N-carbamoyl-2-cyanoacetamide is 93803-53-3.
What is the molecular formula of 2,2-dibromo-N-carbamoyl-2-cyanoacetamide?
The molecular formula of 2,2-dibromo-N-carbamoyl-2-cyanoacetamide is C4H3Br2N3O2.
What is the molecular weight of 2,2-dibromo-N-carbamoyl-2-cyanoacetamide?
The molecular weight of 2,2-dibromo-N-carbamoyl-2-cyanoacetamide is 282.86 g/mol.
Where can I buy 2,2-dibromo-N-carbamoyl-2-cyanoacetamide?
You can request a quote for 2,2-dibromo-N-carbamoyl-2-cyanoacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-dibromo-N-carbamoyl-2-cyanoacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2,2-dibromo-N-carbamoyl-2-cyanoacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.