RefChem:236238
TL;DR: RefChem:236238 (CAS 36040-35-4) is a chemical compound with molecular formula C18H22N2O and molecular weight 282.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-yloxy)-N,N-dimethylethanamine
Also Known As: 5,6-Dihydro-11-(N,N-dimethylaminoethoxy)-11H-benzo(5,6)cyclohepta(1,2-c)pyridine, 11H-Benzo(5,6)cyclohepta(1,2-C)pyridine, 5,6-dihydro-11-(2-(dimethylamino)ethoxy)-, 2-(6,11-dihydro-5h-benzo[5,6]cyclohepta[1,2-c]pyridin-11-yloxy)-n,n-dimethylethanamine, 2-[(6,11-Dihydro-5H-benzo[5,6]cyclohepta[1,2-c]pyridin-11-yl)oxy]-N,N-dimethylethan-1-amine, [2-(6,11-Dihydro-5H-benzo[5,6]cyclohepta[1,2-c]pyridin-11-yloxy)-ethyl]-dimethyl-amine
| Molecular Formula | C18H22N2O |
|---|---|
| Molecular Weight | 282.17 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 25.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 282.17322 |
| Heavy Atoms | 21 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 36040-35-4 |
|---|---|
| SMILES | CN(C)CCOC1C2=CC=CC=C2CCC3=C1C=NC=C3 |
| InChIKey | XJMIRJZHCFTVJF-UHFFFAOYSA-N |
Product Overview
RefChem:236238 (CAS 36040-35-4), with molecular formula C18H22N2O and molecular weight 282.17 g/mol. IUPAC: 2-(5-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-yloxy)-N,N-dimethylethanamine.
Chemical Property Profile of RefChem:236238
Property Insights of RefChem:236238
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:236238. With a topological polar surface area (TPSA) of 25.4 Ų, RefChem:236238 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:236238 has 0 hydrogen bond donor(s) and 3 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:236238?
The CAS number of RefChem:236238 is 36040-35-4.
What is the molecular formula of RefChem:236238?
The molecular formula of RefChem:236238 is C18H22N2O.
What is the molecular weight of RefChem:236238?
The molecular weight of RefChem:236238 is 282.17 g/mol.
Where can I buy RefChem:236238?
You can request a quote for RefChem:236238 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:236238?
Yes, KEHONG BIO provides custom synthesis services for RefChem:236238 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.