RefChem:305580
TL;DR: RefChem:305580 (CAS 87395-65-1) is a chemical compound with molecular formula C23H25NO2 and molecular weight 347.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-azabicyclo[2.2.2]octan-3-yl tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene-2-carboxylate
Also Known As: (+-)-10,11-Dihydro-5H-dibenzo(a,d)cycloheptene-5-carboxylic acid 3-quinuclidinyl ester, 5H-Dibenzo(a,d)cycloheptene-5-carboxylic acid, 10,11-dihydro-, 3-quinuclidinyl ester, (+-)-, 1-Azabicyclo[2.2.2]octan-3-yl 10,11-dihydro-5H-dibenzo[a,d][7]annulene-5-carboxylate, 10,11-Dihydro-5H-dibenzo[a,d]cycloheptene-5-carboxylic acid quinuclidin-3-yl ester, 10,11-Dihydro-5H-dibenzo[a,d]cycloheptene-5-carboxylicacidquinuclidin-3-ylester
| Molecular Formula | C23H25NO2 |
|---|---|
| Molecular Weight | 347.19 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.18854 |
| Heavy Atoms | 26 |
| Complexity | 488.0 |
Chemical Identifiers
| CAS Number | 87395-65-1 |
|---|---|
| SMILES | C1CN2CCC1C(C2)OC(=O)C3C4=CC=CC=C4CCC5=CC=CC=C35 |
| InChIKey | DYANBEYXYZKCOS-UHFFFAOYSA-N |
Product Overview
RefChem:305580 (CAS 87395-65-1), with molecular formula C23H25NO2 and molecular weight 347.19 g/mol. IUPAC: 1-azabicyclo[2.2.2]octan-3-yl tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene-2-carboxylate.
Chemical Property Profile of RefChem:305580
Property Insights of RefChem:305580
The XLogP value of 4.3 indicates that RefChem:305580 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, RefChem:305580 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:305580 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:305580?
The CAS number of RefChem:305580 is 87395-65-1.
What is the molecular formula of RefChem:305580?
The molecular formula of RefChem:305580 is C23H25NO2.
What is the molecular weight of RefChem:305580?
The molecular weight of RefChem:305580 is 347.19 g/mol.
Where can I buy RefChem:305580?
You can request a quote for RefChem:305580 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:305580?
Yes, KEHONG BIO provides custom synthesis services for RefChem:305580 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.