RefChem:76766
TL;DR: RefChem:76766 (CAS 67939-88-2) is a chemical compound with molecular formula C13H14ClF17N2O2S and molecular weight 620.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(dimethylamino)propyl]-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonamide;hydrochloride
Also Known As: N-(3-(Dimethylamino)propyl)heptadecafluorooctanesulphonamide monohydrochloride, N-[3- propyl]heptadecafluorooctanesulphonamidemonohydrochloride, 1-Octanesulfonamide, N-(3-(dimethylamino)propyl)-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-, hydrochloride (1:1), 1-Octanesulfonamide, N-(3-(dimethylamino)propyl)-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-, monohydrochloride, N-(3-(Dimethylamino)propyl)-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-1-octanesulfonamide, hydrochloride
| Molecular Formula | C13H14ClF17N2O2S |
|---|---|
| Molecular Weight | 620.02 g/mol |
| LogP | 5.25 |
| Topological Polar Surface Area | 57.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 12 |
| Exact Mass | 620.0193 |
| Heavy Atoms | 36 |
| Complexity | 845.0 |
Chemical Identifiers
| CAS Number | 67939-88-2 |
|---|---|
| SMILES | CN(C)CCCNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.Cl |
| InChIKey | XJGIKNCQWLRHAA-UHFFFAOYSA-N |
Product Overview
RefChem:76766 (CAS 67939-88-2), with molecular formula C13H14ClF17N2O2S and molecular weight 620.02 g/mol. IUPAC: N-[3-(dimethylamino)propyl]-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonamide;hydrochloride.
Chemical Property Profile of RefChem:76766
Property Insights of RefChem:76766
The XLogP value of 5.25 indicates that RefChem:76766 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.8 Ų, RefChem:76766 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:76766 has 2 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:76766?
The CAS number of RefChem:76766 is 67939-88-2.
What is the molecular formula of RefChem:76766?
The molecular formula of RefChem:76766 is C13H14ClF17N2O2S.
What is the molecular weight of RefChem:76766?
The molecular weight of RefChem:76766 is 620.02 g/mol.
Where can I buy RefChem:76766?
You can request a quote for RefChem:76766 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:76766?
Yes, KEHONG BIO provides custom synthesis services for RefChem:76766 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.