RefChem:318754
TL;DR: RefChem:318754 (CAS 13388-13-1) is a chemical compound with molecular formula C23H30INO and molecular weight 463.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[1-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethoxy)propan-2-yl]azanium iodide
Also Known As: Ammonium, (2-(9,10-dihydro-9,10-ethanoanthracen-11-ylmethoxy)-1-methylethyl)trimethyl-, iodide, (2-(9,10-Dihydro-9,10-ethanoanthracen-11-ylmethoxy)-1-methylethyl)trimethylammonium iodide, 9,10-Dihydro-11-(2-dimethylaminopropoxy)methyl-9,10-ethanoanthracene methyliodide, 9,10-Ethanoanthracene, 9,10-dihydro-11-(2-(dimethylamino)propoxymethyl)-, methyliodide, 1-[(9,10-Dihydro-9,10-ethanoanthracen-11-yl)methoxy]-N,N,N-trimethylpropan-2-aminium iodide
| Molecular Formula | C23H30INO |
|---|---|
| Molecular Weight | 463.14 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 463.1372 |
| Heavy Atoms | 26 |
| Complexity | 431.0 |
Chemical Identifiers
| CAS Number | 13388-13-1 |
|---|---|
| SMILES | CC(COCC1CC2C3=CC=CC=C3C1C4=CC=CC=C24)[N+](C)(C)C.[I-] |
| InChIKey | RPEHMPYZHFMPDD-UHFFFAOYSA-M |
Product Overview
RefChem:318754 (CAS 13388-13-1), with molecular formula C23H30INO and molecular weight 463.14 g/mol. IUPAC: trimethyl-[1-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethoxy)propan-2-yl]azanium iodide.
Chemical Property Profile of RefChem:318754
Property Insights of RefChem:318754
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:318754. With a topological polar surface area (TPSA) of 9.2 Ų, RefChem:318754 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:318754 has 0 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:318754?
The CAS number of RefChem:318754 is 13388-13-1.
What is the molecular formula of RefChem:318754?
The molecular formula of RefChem:318754 is C23H30INO.
What is the molecular weight of RefChem:318754?
The molecular weight of RefChem:318754 is 463.14 g/mol.
Where can I buy RefChem:318754?
You can request a quote for RefChem:318754 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:318754?
Yes, KEHONG BIO provides custom synthesis services for RefChem:318754 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.