![N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide structure](/static/products/815/81534-95-4.png)
N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide
TL;DR: N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide (CAS 81534-95-4) is a chemical compound with molecular formula C12H14Br2N2O4 and molecular weight 407.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide
Also Known As: 2,5-dibromo-3,6-dipropionamidohydroquinone, N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide, N,N'-(2,5-Dibromo-3,6-dihydroxy-1,4-phenylene)dipropanamide, N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propan
| Molecular Formula | C12H14Br2N2O4 |
|---|---|
| Molecular Weight | 407.93 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.93204 |
| Heavy Atoms | 20 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 81534-95-4 |
|---|---|
| SMILES | CCC(=O)NC1=C(C(=C(C(=C1Br)O)NC(=O)CC)Br)O |
| InChIKey | HSTOZTZHONRMKE-UHFFFAOYSA-N |
Product Overview
N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide (CAS 81534-95-4), with molecular formula C12H14Br2N2O4 and molecular weight 407.93 g/mol. IUPAC: N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide.
Chemical Property Profile of N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide
Property Insights of N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide. Following Lipinski's Rule of Five, N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide has 4 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 N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide?
The CAS number of N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide is 81534-95-4.
What is the molecular formula of N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide?
The molecular formula of N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide is C12H14Br2N2O4.
What is the molecular weight of N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide?
The molecular weight of N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide is 407.93 g/mol.
Where can I buy N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide?
You can request a quote for N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2,5-dibromo-3,6-dihydroxy-4-(propanoylamino)phenyl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.