C26H30N2O.2ClH.1/2H2O
TL;DR: C26H30N2O.2ClH.1/2H2O (CAS 125849-30-1) is a chemical compound with molecular formula C26H32Cl2N2O and molecular weight 458.18918 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzyl-N-[2-(2-phenylphenoxy)ethyl]piperidin-4-amine;dihydrochloride
Also Known As: C26H30N2O.2ClH.1/2H2O, N-(1-Benzyl-4-piperidyl)-2-(2-biphenylyloxy)ethylamine dihydrochloride hemihydrate, C26-H30-N2-O.2Cl-H.1/2H2-O, 4-Piperidinamine, N-(2-((1,1'-biphenyl)-2-yloxy)ethyl)-1-(phenylmethyl)-, hydrochloride, hydrate (2:4:1), N-(2-((1,1'-Biphenyl)-2-yloxy)ethyl)-1-(phenylmethyl)-4-piperidinamine hydrochloride
Technical Specifications
| Molecular Formula | C26H32Cl2N2O |
| Molecular Weight | 458.18918 g/mol |
| XLogP | 5.8302 |
| Topological Polar Surface Area (TPSA) | 24.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 458.18918 Da |
| Heavy Atoms | 31 |
| Complexity | 436.0 |
| SMILES | C1CN(CCC1NCCOC2=CC=CC=C2C3=CC=CC=C3)CC4=CC=CC=C4.Cl.Cl |
| InChIKey | YLTHXUBQFRAJCX-UHFFFAOYSA-N |
Chemical Property Profile of C26H30N2O.2ClH.1/2H2O
Property Insights of C26H30N2O.2ClH.1/2H2O
The XLogP value of 5.8302 indicates that C26H30N2O.2ClH.1/2H2O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.5 Ų, C26H30N2O.2ClH.1/2H2O exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C26H30N2O.2ClH.1/2H2O has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of C26H30N2O.2ClH.1/2H2O?
The CAS number of C26H30N2O.2ClH.1/2H2O is 125849-30-1.
What is the molecular formula of C26H30N2O.2ClH.1/2H2O?
The molecular formula of C26H30N2O.2ClH.1/2H2O is C26H32Cl2N2O.
What is the molecular weight of C26H30N2O.2ClH.1/2H2O?
The molecular weight of C26H30N2O.2ClH.1/2H2O is 458.18918 g/mol.
Where can I buy C26H30N2O.2ClH.1/2H2O?
You can request a quote for C26H30N2O.2ClH.1/2H2O directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C26H30N2O.2ClH.1/2H2O?
Yes, CoreyChem provides custom synthesis services for C26H30N2O.2ClH.1/2H2O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.