RefChem:161420
TL;DR: RefChem:161420 (CAS 57718-48-6) is a chemical compound with molecular formula C23H30FN3O2 and molecular weight 399.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-[1-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propyl]piperidin-4-yl]benzene-1,4-diamine
Also Known As: N-(1-(3-(2-(4-Fluorophenyl)-1,3-dioxolan-2-yl)propyl)piperidin-4-yl)benzene-1,4-diamine, N-[1-[3-[2-(4-FLUOROPHENYL)-1,3-DIOXOLAN-2-YL]PROPYL]PIPERIDIN-4-YL]BENZENE-1,4-DIAMINE, 4-N-[1-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propyl]piperidin-4-yl]benzene-1,4-diamine, n-(1-{3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propyl}piperidin-4-yl)benzene-1,4-diamine, N-[1-[3-[2- -1,3-dioxolan-2-yl]propyl]piperidin-4-yl]benzene-1,4-diamine
| Molecular Formula | C23H30FN3O2 |
|---|---|
| Molecular Weight | 399.23 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 59.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 399.2322 |
| Heavy Atoms | 29 |
| Complexity | 479.0 |
Chemical Identifiers
| CAS Number | 57718-48-6 |
|---|---|
| SMILES | C1CN(CCC1NC2=CC=C(C=C2)N)CCCC3(OCCO3)C4=CC=C(C=C4)F |
| InChIKey | HJFIMMPGFZUPEU-UHFFFAOYSA-N |
Product Overview
RefChem:161420 (CAS 57718-48-6), with molecular formula C23H30FN3O2 and molecular weight 399.23 g/mol. IUPAC: 4-N-[1-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propyl]piperidin-4-yl]benzene-1,4-diamine.
Chemical Property Profile of RefChem:161420
Property Insights of RefChem:161420
The XLogP value of 3.6 indicates that RefChem:161420 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.8 Ų, RefChem:161420 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:161420 has 2 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:161420?
The CAS number of RefChem:161420 is 57718-48-6.
What is the molecular formula of RefChem:161420?
The molecular formula of RefChem:161420 is C23H30FN3O2.
What is the molecular weight of RefChem:161420?
The molecular weight of RefChem:161420 is 399.23 g/mol.
Where can I buy RefChem:161420?
You can request a quote for RefChem:161420 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:161420?
Yes, KEHONG BIO provides custom synthesis services for RefChem:161420 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.