RefChem:312971
TL;DR: RefChem:312971 (CAS 6606-05-9) is a chemical compound with molecular formula C24H35NO3 and molecular weight 385.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(9-azabicyclo[3.3.1]nonan-9-yl)ethyl 2-cyclohexyl-2-hydroxy-2-phenylacetate
Also Known As: KSD 2317, 9-(2-Hydroxyethyl)-9-azabicyclo(3.3.1)nonane alpha-hydroxy-alpha-phenylcyclohexaneacetate, 9-Azabicyclo(3.3.1)nonane, 9-(2-hydroxyethyl)-, alpha-hydroxy-alpha-phenylcyclohexaneacetate, N-(omega-Hydroxyethyl)-norgranatan alpha-hydroxy-alpha-phenylcyclohexylacetyl ester [German], 2-(9-Azabicyclo[3.3.1]nonan-9-yl)ethyl2-cyclohexyl-2-hydroxy-2-phenylacetate
| Molecular Formula | C24H35NO3 |
|---|---|
| Molecular Weight | 385.26 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 385.2617 |
| Heavy Atoms | 28 |
| Complexity | 490.0 |
Chemical Identifiers
| CAS Number | 6606-05-9 |
|---|---|
| SMILES | C1CCC(CC1)C(C2=CC=CC=C2)(C(=O)OCCN3C4CCCC3CCC4)O |
| InChIKey | PSMFXKHJRJEIBW-UHFFFAOYSA-N |
Product Overview
RefChem:312971 (CAS 6606-05-9), with molecular formula C24H35NO3 and molecular weight 385.26 g/mol. IUPAC: 2-(9-azabicyclo[3.3.1]nonan-9-yl)ethyl 2-cyclohexyl-2-hydroxy-2-phenylacetate.
Chemical Property Profile of RefChem:312971
Property Insights of RefChem:312971
The XLogP value of 5.2 indicates that RefChem:312971 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, RefChem:312971 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:312971 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:312971?
The CAS number of RefChem:312971 is 6606-05-9.
What is the molecular formula of RefChem:312971?
The molecular formula of RefChem:312971 is C24H35NO3.
What is the molecular weight of RefChem:312971?
The molecular weight of RefChem:312971 is 385.26 g/mol.
Where can I buy RefChem:312971?
You can request a quote for RefChem:312971 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:312971?
Yes, KEHONG BIO provides custom synthesis services for RefChem:312971 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.