RefChem:234684
TL;DR: RefChem:234684 (CAS 16785-27-6) is a chemical compound with molecular formula C23H34Cl2N2O4 and molecular weight 472.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(2-methylphenyl)piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)propan-1-ol;dihydrochloride
Also Known As: 1-Piperazinepropanol, N-(o-tolyl)-alpha-(3,4,5-trimethoxyphenyl)-, dihydrochloride, 1-(gamma-Hydroxy-gamma-(3,4,5-trimethoxyphenyl)propyl)-4-(o-tolyl)piperazine dihydrochloride, 3-(4-(o-Tolyl)piperazinyl)-1-(3,4,5-trimethoxyphenyl)-1-propanol hydrochloride, 1-Propanol, 3-(4-o-tolylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)-, dihydrochloride, 3-[4-(2-methylphenyl)piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)propan-1-ol dihydrochloride
| Molecular Formula | C23H34Cl2N2O4 |
|---|---|
| Molecular Weight | 472.19 g/mol |
| LogP | 4.11012 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 472.18958 |
| Heavy Atoms | 31 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 16785-27-6 |
|---|---|
| SMILES | CC1=CC=CC=C1N2CCN(CC2)CCC(C3=CC(=C(C(=C3)OC)OC)OC)O.Cl.Cl |
| InChIKey | NDFIULMDZSGQIJ-UHFFFAOYSA-N |
Product Overview
RefChem:234684 (CAS 16785-27-6), with molecular formula C23H34Cl2N2O4 and molecular weight 472.19 g/mol. IUPAC: 3-[4-(2-methylphenyl)piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)propan-1-ol;dihydrochloride.
Chemical Property Profile of RefChem:234684
Property Insights of RefChem:234684
The XLogP value of 4.11012 indicates that RefChem:234684 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, RefChem:234684 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:234684 has 3 hydrogen bond donor(s) and 6 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 RefChem:234684?
The CAS number of RefChem:234684 is 16785-27-6.
What is the molecular formula of RefChem:234684?
The molecular formula of RefChem:234684 is C23H34Cl2N2O4.
What is the molecular weight of RefChem:234684?
The molecular weight of RefChem:234684 is 472.19 g/mol.
Where can I buy RefChem:234684?
You can request a quote for RefChem:234684 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:234684?
Yes, KEHONG BIO provides custom synthesis services for RefChem:234684 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.