Dansylpropranolol
TL;DR: Dansylpropranolol (CAS 86247-90-7) is a chemical compound with molecular formula C28H32N2O4S and molecular weight 492.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl] 5-(dimethylamino)naphthalene-1-sulfonate
Also Known As: Dansylpropranolol, 1-Naphthalenesulfonic acid, 5-(dimethylamino)-, 1-(((1-methylethyl)amino)methyl)-2-(1-naphthalenyloxy)ethyl ester, [1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl] 5-(dimethylamino)naphthalene-1-sulfonate, 1-[(Naphthalen-1-yl)oxy]-3-[(propan-2-yl)amino]propan-2-yl 5-(dimethylamino)naphthalene-1-sulfonate, RefChem:130905
| Molecular Formula | C28H32N2O4S |
|---|---|
| Molecular Weight | 492.21 g/mol |
| LogP | 6.9 |
| Topological Polar Surface Area | 76.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 492.20828 |
| Heavy Atoms | 35 |
| Complexity | 753.0 |
Chemical Identifiers
| CAS Number | 86247-90-7 |
|---|---|
| SMILES | CC(C)NCC(COC1=CC=CC2=CC=CC=C21)OS(=O)(=O)C3=CC=CC4=C3C=CC=C4N(C)C |
| InChIKey | KWEDEPWWFMDDSW-UHFFFAOYSA-N |
Product Overview
Dansylpropranolol (CAS 86247-90-7), with molecular formula C28H32N2O4S and molecular weight 492.21 g/mol. IUPAC: [1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-yl] 5-(dimethylamino)naphthalene-1-sulfonate.
Chemical Property Profile of Dansylpropranolol
Property Insights of Dansylpropranolol
The XLogP value of 6.9 indicates that Dansylpropranolol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Dansylpropranolol. Following Lipinski's Rule of Five, Dansylpropranolol has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dansylpropranolol?
The CAS number of Dansylpropranolol is 86247-90-7.
What is the molecular formula of Dansylpropranolol?
The molecular formula of Dansylpropranolol is C28H32N2O4S.
What is the molecular weight of Dansylpropranolol?
The molecular weight of Dansylpropranolol is 492.21 g/mol.
Where can I buy Dansylpropranolol?
You can request a quote for Dansylpropranolol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dansylpropranolol?
Yes, KEHONG BIO provides custom synthesis services for Dansylpropranolol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.