Hydroxyphenacetyl aminoclonidine
TL;DR: Hydroxyphenacetyl aminoclonidine (CAS 76958-98-0) is a chemical compound with molecular formula C17H16Cl2N4O2 and molecular weight 378.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3,5-dichloro-4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-2-(4-hydroxyphenyl)acetamide
Also Known As: Hpaa-clonidine, Hydroxyphenacetyl aminoclonidine, N-(4-Hydroxyphenacetyl)-4-aminoclonidine, N-[3,5-dichloro-4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-2-(4-hydroxyphenyl)acetamide, Benzeneacetamide, N-(3,5-dichloro-4-((4,5-dihydro-1H-imidazol-2-yl)amino)phenyl)-4-hydroxy-
| Molecular Formula | C17H16Cl2N4O2 |
|---|---|
| Molecular Weight | 378.07 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 85.8 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.06503 |
| Heavy Atoms | 25 |
| Complexity | 485.0 |
Chemical Identifiers
| CAS Number | 76958-98-0 |
|---|---|
| SMILES | C1CN=C(N1)NC2=C(C=C(C=C2Cl)NC(=O)CC3=CC=C(C=C3)O)Cl |
| InChIKey | FPYNMDKUOPKZOH-UHFFFAOYSA-N |
Product Overview
Hydroxyphenacetyl aminoclonidine (CAS 76958-98-0), with molecular formula C17H16Cl2N4O2 and molecular weight 378.07 g/mol. IUPAC: N-[3,5-dichloro-4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-2-(4-hydroxyphenyl)acetamide.
Chemical Property Profile of Hydroxyphenacetyl aminoclonidine
Property Insights of Hydroxyphenacetyl aminoclonidine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydroxyphenacetyl aminoclonidine. The TPSA of 85.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydroxyphenacetyl aminoclonidine. Following Lipinski's Rule of Five, Hydroxyphenacetyl aminoclonidine has 4 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 Hydroxyphenacetyl aminoclonidine?
The CAS number of Hydroxyphenacetyl aminoclonidine is 76958-98-0.
What is the molecular formula of Hydroxyphenacetyl aminoclonidine?
The molecular formula of Hydroxyphenacetyl aminoclonidine is C17H16Cl2N4O2.
What is the molecular weight of Hydroxyphenacetyl aminoclonidine?
The molecular weight of Hydroxyphenacetyl aminoclonidine is 378.07 g/mol.
Where can I buy Hydroxyphenacetyl aminoclonidine?
You can request a quote for Hydroxyphenacetyl aminoclonidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxyphenacetyl aminoclonidine?
Yes, KEHONG BIO provides custom synthesis services for Hydroxyphenacetyl aminoclonidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.