RefChem:312585
TL;DR: RefChem:312585 (CAS 13388-09-5) is a chemical compound with molecular formula C23H28ClNO and molecular weight 369.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethoxy)ethyl]pyrrolidine;hydrochloride
Also Known As: 9,10-Dihydro-11-((2-pyrrolidinylethoxy)methyl)-9,10-ethanoanthracene hydrochloride, 11-((2-Pyrrolidinylethoxy)methyl)-9,10-dihydro-9,10-ethanoanthracene hydrochloride, 9,10-Ethanoanthracene, 9,10-dihydro-11-((2-pyrrolidinylethoxy)methyl)-, hydrochloride, 1-{2-[(9,10-Dihydro-9,10-ethanoanthracen-11-yl)methoxy]ethyl}pyrrolidine--hydrogen chloride (1/1), Pyrrolidine, 1-[2-[(9,10-dihydro-9,10-ethanoanthracen-11-yl)methoxy]ethyl]-, hydrochloride
| Molecular Formula | C23H28ClNO |
|---|---|
| Molecular Weight | 369.19 g/mol |
| LogP | 4.8179 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 369.18594 |
| Heavy Atoms | 26 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 13388-09-5 |
|---|---|
| SMILES | C1CCN(C1)CCOCC2CC3C4=CC=CC=C4C2C5=CC=CC=C35.Cl |
| InChIKey | MQBSEVHSROUCLA-UHFFFAOYSA-N |
Product Overview
RefChem:312585 (CAS 13388-09-5), with molecular formula C23H28ClNO and molecular weight 369.19 g/mol. IUPAC: 1-[2-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethoxy)ethyl]pyrrolidine;hydrochloride.
Chemical Property Profile of RefChem:312585
Property Insights of RefChem:312585
The XLogP value of 4.8179 indicates that RefChem:312585 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, RefChem:312585 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:312585 has 1 hydrogen bond donor(s) and 2 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:312585?
The CAS number of RefChem:312585 is 13388-09-5.
What is the molecular formula of RefChem:312585?
The molecular formula of RefChem:312585 is C23H28ClNO.
What is the molecular weight of RefChem:312585?
The molecular weight of RefChem:312585 is 369.19 g/mol.
Where can I buy RefChem:312585?
You can request a quote for RefChem:312585 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:312585?
Yes, KEHONG BIO provides custom synthesis services for RefChem:312585 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.