RefChem:329183
TL;DR: RefChem:329183 (CAS 49832-44-2) is a chemical compound with molecular formula C19H31NO and molecular weight 289.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,3-trimethyl-2-(4-piperidin-1-ylbut-2-ynyl)bicyclo[2.2.1]heptan-2-ol
Also Known As: endo-2-(4-(1-Piperidinyl)-2-butynyl)-1,3,3-trimethylbicyclo(2.2.1)heptan-2-ol, Bicyclo(2.2.1)heptan-2-ol, 2-(4-(1-piperidinyl)-2-butynyl)-1,3,3-trimethyl-, endo-, 2,2,4-trimethyl-3-(4-piperidin-1-ylbut-2-ynyl)bicyclo[2.2.1]heptan-3-ol, 1,3,3-TRIMETHYL-2-[4-(PIPERIDIN-1-YL)BUT-2-YN-1-YL]BICYCLO[2.2.1]HEPTAN-2-OL, BRN 1250290
| Molecular Formula | C19H31NO |
|---|---|
| Molecular Weight | 289.24 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.24057 |
| Heavy Atoms | 21 |
| Complexity | 464.0 |
Chemical Identifiers
| CAS Number | 49832-44-2 |
|---|---|
| SMILES | CC1(C2CCC(C2)(C1(CC#CCN3CCCCC3)O)C)C |
| InChIKey | SFAKAJJMWNPZKN-UHFFFAOYSA-N |
Product Overview
RefChem:329183 (CAS 49832-44-2), with molecular formula C19H31NO and molecular weight 289.24 g/mol. IUPAC: 1,3,3-trimethyl-2-(4-piperidin-1-ylbut-2-ynyl)bicyclo[2.2.1]heptan-2-ol.
Chemical Property Profile of RefChem:329183
Property Insights of RefChem:329183
The XLogP value of 3.7 indicates that RefChem:329183 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.5 Ų, RefChem:329183 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:329183 has 1 hydrogen bond donor(s) and 2 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:329183?
The CAS number of RefChem:329183 is 49832-44-2.
What is the molecular formula of RefChem:329183?
The molecular formula of RefChem:329183 is C19H31NO.
What is the molecular weight of RefChem:329183?
The molecular weight of RefChem:329183 is 289.24 g/mol.
Where can I buy RefChem:329183?
You can request a quote for RefChem:329183 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:329183?
Yes, KEHONG BIO provides custom synthesis services for RefChem:329183 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.