RefChem:1087741
TL;DR: RefChem:1087741 (CAS 102395-78-8) is a chemical compound with molecular formula C18H30Cl2N2O2 and molecular weight 376.16843 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6,7-dimethoxy-2-(2-piperidin-1-ium-1-ylethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium dichloride
Also Known As: Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-2-(2-piperidinoethxy)-, dihydrochloride, 1,2,3,4-Tetrahydro-6,7-dimethoxy-2-(2-piperidinoethyl)isoquinoline dihydrochloride, 6,7-dimethoxy-2-(2-piperidin-1-ium-1-ylethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium dichloride, 6,7-dimethoxy-2-(2-piperidin-1-ium-1-ylethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium;dichloride, N-(beta-Piperidinoetil)-6,7-dimetossi-1,2,3,4-tetraidroisochinoline dicloridrato [Italian]
Technical Specifications
| Molecular Formula | C18H30Cl2N2O2 |
| Molecular Weight | 376.16843 g/mol |
| XLogP | -6.28 |
| Topological Polar Surface Area (TPSA) | 27.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 376.16843 Da |
| Heavy Atoms | 24 |
| Complexity | 333.0 |
| SMILES | COC1=C(C=C2C[NH+](CCC2=C1)CC[NH+]3CCCCC3)OC.[Cl-].[Cl-] |
| InChIKey | CBHBXXOIGADZBY-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:1087741
Property Insights of RefChem:1087741
The XLogP value of -6.28 indicates that RefChem:1087741 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 27.3 Ų, RefChem:1087741 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1087741 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1087741?
The CAS number of RefChem:1087741 is 102395-78-8.
What is the molecular formula of RefChem:1087741?
The molecular formula of RefChem:1087741 is C18H30Cl2N2O2.
What is the molecular weight of RefChem:1087741?
The molecular weight of RefChem:1087741 is 376.16843 g/mol.
Where can I buy RefChem:1087741?
You can request a quote for RefChem:1087741 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1087741?
Yes, CoreyChem provides custom synthesis services for RefChem:1087741 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.