RefChem:335249
TL;DR: RefChem:335249 (CAS 101564-18-5) is a chemical compound with molecular formula C15H25BrN2O2 and molecular weight 344.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl)cyclohexane-1-carbonitrile;hydrobromide
Also Known As: 1,4-Dioxa-6-methyl-8-aza-8-(1-cyanocyclohexyl)spiro(4,5)decane hydrobromide, 1-(6-Methyl-1,4-dioxa-8-azaspiro(4,5)dec-8-yl)cyclohexanecarbonitrile hydrobromide, Cyclohexanecarbonitrile, 1-(6-methyl-1,4-dioxa-8-azaspiro(4,5)dec-8-yl)-, hydrobromide, 1-(10-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl)cyclohexane-1-carbonitrile hydrobromide, 1-(6-Methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl)cyclohexane-1-carbonitrile--hydrogen bromide (1/1)
| Molecular Formula | C15H25BrN2O2 |
|---|---|
| Molecular Weight | 344.11 g/mol |
| LogP | 2.87568 |
| Topological Polar Surface Area | 45.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 344.10995 |
| Heavy Atoms | 20 |
| Complexity | 370.56003 |
Chemical Identifiers
| CAS Number | 101564-18-5 |
|---|---|
| SMILES | CC1CN(CCC12OCCO2)C3(CCCCC3)C#N.Br |
Product Overview
RefChem:335249 (CAS 101564-18-5), with molecular formula C15H25BrN2O2 and molecular weight 344.11 g/mol. IUPAC: 1-(6-methyl-1,4-dioxa-8-azaspiro[4.5]decan-8-yl)cyclohexane-1-carbonitrile;hydrobromide.
Chemical Property Profile of RefChem:335249
Property Insights of RefChem:335249
The XLogP value of 2.87568 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:335249. With a topological polar surface area (TPSA) of 45.49 Ų, RefChem:335249 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:335249 has 0 hydrogen bond donor(s) and 4 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:335249?
The CAS number of RefChem:335249 is 101564-18-5.
What is the molecular formula of RefChem:335249?
The molecular formula of RefChem:335249 is C15H25BrN2O2.
What is the molecular weight of RefChem:335249?
The molecular weight of RefChem:335249 is 344.11 g/mol.
Where can I buy RefChem:335249?
You can request a quote for RefChem:335249 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:335249?
Yes, KEHONG BIO provides custom synthesis services for RefChem:335249 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.