C27H32N2O2.2ClH.3/2H2O
TL;DR: C27H32N2O2.2ClH.3/2H2O (CAS 79333-01-0) is a chemical compound with molecular formula C27H34Cl2N2O2 and molecular weight 488.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-4-[3-(2-methoxyphenoxy)-3-phenylpropyl]piperazine;dihydrochloride
Also Known As: C27H32N2O2.2ClH.3/2H2O, C27-H32-N2-O2.2Cl-H.3/2H2-O, 1-(3-(2-Methoxyphenoxy)-3-phenylpropyl)-4-(phenylmethyl)piperazine hydrochloride H2O (2:4:3), Piperazine, 1-(3-(2-methoxyphenoxy)-3-phenylpropyl)-4-(phenylmethyl)-, hydrochloride, hydrate (2:4:3), 1-benzyl-4-[3-(2-methoxyphenoxy)-3-phenylpropyl]piperazine dihydrochloride
| Molecular Formula | C27H34Cl2N2O2 |
|---|---|
| Molecular Weight | 488.20 g/mol |
| LogP | 5.8668 |
| Topological Polar Surface Area | 24.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 488.19974 |
| Heavy Atoms | 33 |
| Complexity | 919.6741 |
Chemical Identifiers
| CAS Number | 79333-01-0 |
|---|---|
| SMILES | COC1=CC=CC=C1OC(CCN2CCN(CC2)CC3=CC=CC=C3)C4=CC=CC=C4.Cl.Cl |
Product Overview
C27H32N2O2.2ClH.3/2H2O (CAS 79333-01-0), with molecular formula C27H34Cl2N2O2 and molecular weight 488.20 g/mol. IUPAC: 1-benzyl-4-[3-(2-methoxyphenoxy)-3-phenylpropyl]piperazine;dihydrochloride.
Chemical Property Profile of C27H32N2O2.2ClH.3/2H2O
Property Insights of C27H32N2O2.2ClH.3/2H2O
The XLogP value of 5.8668 indicates that C27H32N2O2.2ClH.3/2H2O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.94 Ų, C27H32N2O2.2ClH.3/2H2O exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C27H32N2O2.2ClH.3/2H2O has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C27H32N2O2.2ClH.3/2H2O?
The CAS number of C27H32N2O2.2ClH.3/2H2O is 79333-01-0.
What is the molecular formula of C27H32N2O2.2ClH.3/2H2O?
The molecular formula of C27H32N2O2.2ClH.3/2H2O is C27H34Cl2N2O2.
What is the molecular weight of C27H32N2O2.2ClH.3/2H2O?
The molecular weight of C27H32N2O2.2ClH.3/2H2O is 488.20 g/mol.
Where can I buy C27H32N2O2.2ClH.3/2H2O?
You can request a quote for C27H32N2O2.2ClH.3/2H2O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C27H32N2O2.2ClH.3/2H2O?
Yes, KEHONG BIO provides custom synthesis services for C27H32N2O2.2ClH.3/2H2O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.