RefChem:334458
TL;DR: RefChem:334458 (CAS 63446-05-9) is a chemical compound with molecular formula C19H26ClNO7 and molecular weight 415.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-hydroxy-3-morpholin-4-ium-4-ylpropoxy)-7,8-dimethoxy-4-methylchromen-2-one chloride
Also Known As: Coumarin, 7,8-dimethoxy-6-(2-hydroxy-3-morpholinopropoxy)-4-methyl-, hydrochloride, 7,8-Dimethoxy-4-methyl-6-(3-morpholino-2-hydroxypropoxy)coumarin hydrochloride, 6-(2-hydroxy-3-morpholin-4-ium-4-ylpropoxy)-7,8-dimethoxy-4-methylchromen-2-one chloride, RefChem:334458
| Molecular Formula | C19H26ClNO7 |
|---|---|
| Molecular Weight | 415.14 g/mol |
| LogP | -3.22 |
| Topological Polar Surface Area | 87.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 415.13977 |
| Heavy Atoms | 28 |
| Complexity | 534.0 |
Chemical Identifiers
| CAS Number | 63446-05-9 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C(C(=C(C=C12)OCC(C[NH+]3CCOCC3)O)OC)OC.[Cl-] |
| InChIKey | GGRAKVSCMKKXKS-UHFFFAOYSA-N |
Product Overview
RefChem:334458 (CAS 63446-05-9), with molecular formula C19H26ClNO7 and molecular weight 415.14 g/mol. IUPAC: 6-(2-hydroxy-3-morpholin-4-ium-4-ylpropoxy)-7,8-dimethoxy-4-methylchromen-2-one chloride.
Chemical Property Profile of RefChem:334458
Property Insights of RefChem:334458
The XLogP value of -3.22 indicates that RefChem:334458 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 87.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:334458. Following Lipinski's Rule of Five, RefChem:334458 has 2 hydrogen bond donor(s) and 8 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:334458?
The CAS number of RefChem:334458 is 63446-05-9.
What is the molecular formula of RefChem:334458?
The molecular formula of RefChem:334458 is C19H26ClNO7.
What is the molecular weight of RefChem:334458?
The molecular weight of RefChem:334458 is 415.14 g/mol.
Where can I buy RefChem:334458?
You can request a quote for RefChem:334458 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:334458?
Yes, KEHONG BIO provides custom synthesis services for RefChem:334458 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.