RefChem:369356
TL;DR: RefChem:369356 (CAS 63957-42-6) is a chemical compound with molecular formula C44H70Cl4N4O5 and molecular weight 874.41003 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(3-[1-[2-(4-aminophenyl)ethyl]-3-(2-methylpropyl)pyrrolidin-3-yl]phenol);trihydrate;tetrahydrochloride
Also Known As: 3-{1-[2-(4-aminophenyl)ethyl]-3-(2-methylpropyl)pyrrolidin-3-yl}phenol hydrochloride hydrate(2:4:3), Phenol, m-(1-(p-aminophenethyl)-3-(2-methylpropyl)-3-pyrrolidinyl)-, dihydrochloride, sesquihydrate, 3-[1-[2-(4-aminophenyl)ethyl]-3-(2-methylpropyl)pyrrolidin-3-yl]phenol trihydrate tetrahydrochloride, 3-{1-[2-(4-Aminophenyl)ethyl]-3-(2-methylpropyl)pyrrolidin-3-yl}phenol--hydrogen chloride--water (2/4/3)
Technical Specifications
| Molecular Formula | C44H70Cl4N4O5 |
| Molecular Weight | 874.41003 g/mol |
| XLogP | 7.63 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 876.4071 Da |
| Heavy Atoms | 57 |
| Complexity | 405.0 |
| SMILES | CC(C)CC1(CCN(C1)CCC2=CC=C(C=C2)N)C3=CC(=CC=C3)O.CC(C)CC1(CCN(C1)CCC2=CC=C(C=C2)N)C3=CC(=CC=C3)O.O.O.O.Cl.Cl.Cl.Cl |
| InChIKey | UGTIKSYRXJAXGJ-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:369356
Property Insights of RefChem:369356
The XLogP value of 7.63 indicates that RefChem:369356 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:369356. Following Lipinski's Rule of Five, RefChem:369356 has 11 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:369356?
The CAS number of RefChem:369356 is 63957-42-6.
What is the molecular formula of RefChem:369356?
The molecular formula of RefChem:369356 is C44H70Cl4N4O5.
What is the molecular weight of RefChem:369356?
The molecular weight of RefChem:369356 is 874.41003 g/mol.
Where can I buy RefChem:369356?
You can request a quote for RefChem:369356 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:369356?
Yes, CoreyChem provides custom synthesis services for RefChem:369356 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.