RefChem:301235
TL;DR: RefChem:301235 (CAS 74229-21-3) is a chemical compound with molecular formula C28H31N3O2 and molecular weight 441.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(dimethylamino)methyl]-3-phenyl-2-[(4-phenylpiperazin-1-yl)methyl]-1-benzofuran-5-ol
Also Known As: 5-Benzofuranol, 4-(dimethylaminomethyl)-3-phenyl-2-((4-phenyl-1-piperazinyl)methyl)-, 5-Hydroxy-4-dimethylaminomethyl-3-phenyl-2-(N-phenylpiperazinomethyl)benzofuran, 4-[(dimethylamino)methyl]-3-phenyl-2-[(4-phenylpiperazin-1-yl)methyl]-1-benzofuran-5-ol, 4-(Dimethylaminomethyl)-3-phenyl-2-[(4-phenyl-1-piperazinyl)methyl]benzofuran-5-ol, 4-(dimethylaminomethyl)-3-phenyl-2-[(4-phenylpiperazin-1-yl)methyl]-1-benzofuran-5-ol
| Molecular Formula | C28H31N3O2 |
|---|---|
| Molecular Weight | 441.24 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 441.24164 |
| Heavy Atoms | 33 |
| Complexity | 596.0 |
Chemical Identifiers
| CAS Number | 74229-21-3 |
|---|---|
| SMILES | CN(C)CC1=C(C=CC2=C1C(=C(O2)CN3CCN(CC3)C4=CC=CC=C4)C5=CC=CC=C5)O |
| InChIKey | BQIVMMXLSDBMCJ-UHFFFAOYSA-N |
Product Overview
RefChem:301235 (CAS 74229-21-3), with molecular formula C28H31N3O2 and molecular weight 441.24 g/mol. IUPAC: 4-[(dimethylamino)methyl]-3-phenyl-2-[(4-phenylpiperazin-1-yl)methyl]-1-benzofuran-5-ol.
Chemical Property Profile of RefChem:301235
Property Insights of RefChem:301235
The XLogP value of 4.9 indicates that RefChem:301235 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.1 Ų, RefChem:301235 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:301235 has 1 hydrogen bond donor(s) and 5 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:301235?
The CAS number of RefChem:301235 is 74229-21-3.
What is the molecular formula of RefChem:301235?
The molecular formula of RefChem:301235 is C28H31N3O2.
What is the molecular weight of RefChem:301235?
The molecular weight of RefChem:301235 is 441.24 g/mol.
Where can I buy RefChem:301235?
You can request a quote for RefChem:301235 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:301235?
Yes, KEHONG BIO provides custom synthesis services for RefChem:301235 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.