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Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French]
TL;DR: Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French] (CAS 55315-96-3) is a chemical compound with molecular formula C19H26Cl2N2O3 and molecular weight 400.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(diethylamino)-3-phenoxypropan-2-yl] pyridine-3-carboxylate;dihydrochloride
Also Known As: Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French], 3-Pyridinecarboxylic acid, 1-((diethylamino)methyl)-2-phenoxyethyl ester, dihydrochloride, Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate, 1-(Diethylamino)-3-phenoxypropan-2-yl pyridine-3-carboxylate--hydrogen chloride (1/2), [1-(diethylamino)-3-phenoxypropan-2-yl] pyridine-3-carboxylate dihydrochloride
| Molecular Formula | C19H26Cl2N2O3 |
|---|---|
| Molecular Weight | 400.13 g/mol |
| LogP | 3.8714 |
| Topological Polar Surface Area | 51.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 400.13205 |
| Heavy Atoms | 26 |
| Complexity | 610.696 |
Chemical Identifiers
| CAS Number | 55315-96-3 |
|---|---|
| SMILES | CCN(CC)CC(COC1=CC=CC=C1)OC(=O)C2=CN=CC=C2.Cl.Cl |
Product Overview
Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French] (CAS 55315-96-3), with molecular formula C19H26Cl2N2O3 and molecular weight 400.13 g/mol. IUPAC: [1-(diethylamino)-3-phenoxypropan-2-yl] pyridine-3-carboxylate;dihydrochloride.
Chemical Property Profile of Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French]
Property Insights of Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French]
The XLogP value of 3.8714 indicates that Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.66 Ų, Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French] exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French] has 0 hydrogen bond donor(s) and 5 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 Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French]?
The CAS number of Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French] is 55315-96-3.
What is the molecular formula of Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French]?
The molecular formula of Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French] is C19H26Cl2N2O3.
What is the molecular weight of Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French]?
The molecular weight of Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French] is 400.13 g/mol.
Where can I buy Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French]?
You can request a quote for Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French]?
Yes, KEHONG BIO provides custom synthesis services for Nicotinate de N,N-diethylamino-3 phenoxy-1 propanol-2 dichlorhydrate [French] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.