C16H26N2O.2ClH.1/2H2O
TL;DR: C16H26N2O.2ClH.1/2H2O (CAS 126002-30-0) is a chemical compound with molecular formula C16H28Cl2N2O and molecular weight 334.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(2-piperidin-1-ylethoxy)phenyl]propan-2-amine;dihydrochloride
Also Known As: C16H26N2O.2ClH.1/2H2O, alpha-Methyl-4-(2-(1-piperidinyl)ethoxy)benzeneethanamine dihydrochloride hydrate (2:4:1), C16-H26-N2-O.2Cl-H.1/2H2-O, Benzeneethanamine, alpha-methyl-4-(2-(1-piperidinyl)ethoxy)-, dihydrochloride, hydrate (2:4:1), 1-[4-(2-piperidin-1-ylethoxy)phenyl]propan-2-amine dihydrochloride
| Molecular Formula | C16H28Cl2N2O |
|---|---|
| Molecular Weight | 334.16 g/mol |
| LogP | 3.2846 |
| Topological Polar Surface Area | 38.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 334.15787 |
| Heavy Atoms | 21 |
| Complexity | 365.04465 |
Chemical Identifiers
| CAS Number | 126002-30-0 |
|---|---|
| SMILES | CC(CC1=CC=C(C=C1)OCCN2CCCCC2)N.Cl.Cl |
Product Overview
C16H26N2O.2ClH.1/2H2O (CAS 126002-30-0), with molecular formula C16H28Cl2N2O and molecular weight 334.16 g/mol. IUPAC: 1-[4-(2-piperidin-1-ylethoxy)phenyl]propan-2-amine;dihydrochloride.
Chemical Property Profile of C16H26N2O.2ClH.1/2H2O
Property Insights of C16H26N2O.2ClH.1/2H2O
The XLogP value of 3.2846 indicates that C16H26N2O.2ClH.1/2H2O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.49 Ų, C16H26N2O.2ClH.1/2H2O exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C16H26N2O.2ClH.1/2H2O has 1 hydrogen bond donor(s) and 3 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 C16H26N2O.2ClH.1/2H2O?
The CAS number of C16H26N2O.2ClH.1/2H2O is 126002-30-0.
What is the molecular formula of C16H26N2O.2ClH.1/2H2O?
The molecular formula of C16H26N2O.2ClH.1/2H2O is C16H28Cl2N2O.
What is the molecular weight of C16H26N2O.2ClH.1/2H2O?
The molecular weight of C16H26N2O.2ClH.1/2H2O is 334.16 g/mol.
Where can I buy C16H26N2O.2ClH.1/2H2O?
You can request a quote for C16H26N2O.2ClH.1/2H2O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C16H26N2O.2ClH.1/2H2O?
Yes, KEHONG BIO provides custom synthesis services for C16H26N2O.2ClH.1/2H2O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.