RefChem:305589
TL;DR: RefChem:305589 (CAS 68263-44-5) is a chemical compound with molecular formula C21H28ClN and molecular weight 329.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[3-(5-methyl-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)propyl]azanium chloride
Also Known As: N,N,3-Trimethyl-10,11-dihydro-5H-dibenzo(a,d)cycloheptene-5-propylamine hydrochloride, 5H-Dibenzo(a,d)cycloheptene-5-propylamine, 10,11-dihydro-N,N,3-trimethyl-, monohydrochloride
| Molecular Formula | C21H28ClN |
|---|---|
| Molecular Weight | 329.19 g/mol |
| LogP | 0.15 |
| Topological Polar Surface Area | 4.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 329.19104 |
| Heavy Atoms | 23 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 68263-44-5 |
|---|---|
| SMILES | CC1=CC2=C(CCC3=CC=CC=C3C2CCC[NH+](C)C)C=C1.[Cl-] |
| InChIKey | DGHSFLRNOAWBJD-UHFFFAOYSA-N |
Product Overview
RefChem:305589 (CAS 68263-44-5), with molecular formula C21H28ClN and molecular weight 329.19 g/mol. IUPAC: dimethyl-[3-(5-methyl-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)propyl]azanium chloride.
Chemical Property Profile of RefChem:305589
Property Insights of RefChem:305589
The XLogP value of 0.15 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:305589. With a topological polar surface area (TPSA) of 4.4 Ų, RefChem:305589 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:305589 has 1 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:305589?
The CAS number of RefChem:305589 is 68263-44-5.
What is the molecular formula of RefChem:305589?
The molecular formula of RefChem:305589 is C21H28ClN.
What is the molecular weight of RefChem:305589?
The molecular weight of RefChem:305589 is 329.19 g/mol.
Where can I buy RefChem:305589?
You can request a quote for RefChem:305589 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:305589?
Yes, KEHONG BIO provides custom synthesis services for RefChem:305589 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.