RefChem:234090
TL;DR: RefChem:234090 (CAS 434-91-3) is a chemical compound with molecular formula C22H32Cl2N2O and molecular weight 410.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-4-(4-methylpiperazin-1-yl)-2-phenylbutan-2-ol;dihydrochloride
Also Known As: 1,3-Diphenyl-1-methyl-2-(4-methyl-1-piperazinylmethyl)-1-propanol dihydrochloride, 1-Piperazinepropanol, beta-benzyl-alpha,4-dimethyl-alpha-phenyl-, dihydrochloride, 1-Propanol, 1,3-diphenyl-1-methyl-2-(4-methyl-1-piperazinylmethyl)-, dihydrochloride, 3-benzyl-4-(4-methylpiperazin-1-yl)-2-phenylbutan-2-ol dihydrochloride, 3-benzyl-4-(4-methylpiperazin-1-yl)-2-phenylbutan-2-ol,dihydrochloride
| Molecular Formula | C22H32Cl2N2O |
|---|---|
| Molecular Weight | 410.19 g/mol |
| LogP | 3.844 |
| Topological Polar Surface Area | 26.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 410.18918 |
| Heavy Atoms | 27 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 434-91-3 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)(C(CC2=CC=CC=C2)CN3CCN(CC3)C)O.Cl.Cl |
| InChIKey | OBQRAKLBUBNLHU-UHFFFAOYSA-N |
Product Overview
RefChem:234090 (CAS 434-91-3), with molecular formula C22H32Cl2N2O and molecular weight 410.19 g/mol. IUPAC: 3-benzyl-4-(4-methylpiperazin-1-yl)-2-phenylbutan-2-ol;dihydrochloride.
Chemical Property Profile of RefChem:234090
Property Insights of RefChem:234090
The XLogP value of 3.844 indicates that RefChem:234090 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.7 Ų, RefChem:234090 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:234090 has 3 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 RefChem:234090?
The CAS number of RefChem:234090 is 434-91-3.
What is the molecular formula of RefChem:234090?
The molecular formula of RefChem:234090 is C22H32Cl2N2O.
What is the molecular weight of RefChem:234090?
The molecular weight of RefChem:234090 is 410.19 g/mol.
Where can I buy RefChem:234090?
You can request a quote for RefChem:234090 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:234090?
Yes, KEHONG BIO provides custom synthesis services for RefChem:234090 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.