RefChem:309450
TL;DR: RefChem:309450 (CAS 101832-31-9) is a chemical compound with molecular formula C25H33ClN2O5 and molecular weight 476.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6aS)-1,2,11-trimethoxy-6-(2-morpholin-4-ylethyl)-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-10-ol chloride
Also Known As: 6a-alpha-Noraporphin-9-ol, 6-(2-morpholinoethyl)-1,2,10-trimethoxy-, monohydrochloride, 6-(2-Morpholinoethyl)-1,2,10-trimethoxy-6a-alpha-noraporphin-9-ol monohydrochloride, (6as)-10-hydroxy-1,2,11-trimethoxy-6-[2-(morpholin-4-yl)ethyl]-5,6,6a,7-tetrahydro-4h-dibenzo[de,g]quinolinium chloride, RefChem:309450
| Molecular Formula | C25H33ClN2O5 |
|---|---|
| Molecular Weight | 476.21 g/mol |
| LogP | -1.54 |
| Topological Polar Surface Area | 64.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 476.2078 |
| Heavy Atoms | 33 |
| Complexity | 617.0 |
Chemical Identifiers
| CAS Number | 101832-31-9 |
|---|---|
| SMILES | COC1=C(C2=C3[C@H](CC4=C2C(=C(C=C4)O)OC)[NH+](CCC3=C1)CCN5CCOCC5)OC.[Cl-] |
| InChIKey | CCNMYQDGVXUNTL-FERBBOLQSA-N |
Product Overview
RefChem:309450 (CAS 101832-31-9), with molecular formula C25H33ClN2O5 and molecular weight 476.21 g/mol. IUPAC: (6aS)-1,2,11-trimethoxy-6-(2-morpholin-4-ylethyl)-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-10-ol chloride.
Chemical Property Profile of RefChem:309450
Property Insights of RefChem:309450
The XLogP value of -1.54 indicates that RefChem:309450 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 64.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:309450. Following Lipinski's Rule of Five, RefChem:309450 has 2 hydrogen bond donor(s) and 7 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:309450?
The CAS number of RefChem:309450 is 101832-31-9.
What is the molecular formula of RefChem:309450?
The molecular formula of RefChem:309450 is C25H33ClN2O5.
What is the molecular weight of RefChem:309450?
The molecular weight of RefChem:309450 is 476.21 g/mol.
Where can I buy RefChem:309450?
You can request a quote for RefChem:309450 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:309450?
Yes, KEHONG BIO provides custom synthesis services for RefChem:309450 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.