RefChem:1066952
TL;DR: RefChem:1066952 (CAS 14692-52-5) is a chemical compound with molecular formula C22H28IN and molecular weight 433.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[3-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)propyl]azanium iodide
Also Known As: 9,10-Dihydro-11-(3-dimethylaminopropyl)9,10-ethanoanthracene methyliodide, (3-(9,10-Dihydro-9,10-ethanoanthracen-11-yl)propyl)trimethylammonium iodide, 9,10-Ethanoanthracene, 9,10-dihydro-11-(3-(dimethylamino)propyl)-, methyliodide, AMMONIUM, (3-(9,10-DIHYDRO-9,10-ETHANOANTHRACEN-11-YL)PROPYL)TRIMETHYL-, IODIDE, 3-(9,10-dihydro-9,10-ethanoanthracen-11-yl)-N,N,N-trimethylpropan-1-aminium iodide
| Molecular Formula | C22H28IN |
|---|---|
| Molecular Weight | 433.13 g/mol |
| LogP | 1.77 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 433.12665 |
| Heavy Atoms | 24 |
| Complexity | 385.0 |
Chemical Identifiers
| CAS Number | 14692-52-5 |
|---|---|
| SMILES | C[N+](C)(C)CCCC1CC2C3=CC=CC=C3C1C4=CC=CC=C24.[I-] |
| InChIKey | IOTKTDIBFJBRNR-UHFFFAOYSA-M |
Product Overview
RefChem:1066952 (CAS 14692-52-5), with molecular formula C22H28IN and molecular weight 433.13 g/mol. IUPAC: trimethyl-[3-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)propyl]azanium iodide.
Chemical Property Profile of RefChem:1066952
Property Insights of RefChem:1066952
The XLogP value of 1.77 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1066952. With a topological polar surface area (TPSA) of 0.0 Ų, RefChem:1066952 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1066952 has 0 hydrogen bond donor(s) and 1 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:1066952?
The CAS number of RefChem:1066952 is 14692-52-5.
What is the molecular formula of RefChem:1066952?
The molecular formula of RefChem:1066952 is C22H28IN.
What is the molecular weight of RefChem:1066952?
The molecular weight of RefChem:1066952 is 433.13 g/mol.
Where can I buy RefChem:1066952?
You can request a quote for RefChem:1066952 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1066952?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1066952 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.