RefChem:305647
TL;DR: RefChem:305647 (CAS 55165-33-8) is a chemical compound with molecular formula C26H30ClNO6 and molecular weight 487.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl-[2-hydroxy-3-(9-methoxy-2-methyl-4-oxofuro[3,2-g]chromen-5-yl)oxypropyl]-propan-2-ylazanium chloride
Also Known As: 5H-Furo(3,2-g)(1)benzopyran-5-one, 4-(3-(benzylisopropylamino)-2-hydroxypropoxy)-9-methoxy-7-methyl-, hydrochloride, Furo(3,2-g)chromone, 4-(3-benzylisopropylamino-2-hydroxypropoxy)-9-methoxy-7-methyl-, hcl, benzyl-[2-hydroxy-3-(9-methoxy-2-methyl-4-oxofuro[3,2-g]chromen-5-yl)oxypropyl]-propan-2-ylazanium chloride, 5H-FURO(3,2-g)(1)BENZOPYRAN-5-ONE, 4-(3-(BENZYLISOPROPYLAMINO)-2-HYDROXYPROPOXY), 5H-Furo[3,2-g][1]benzopyran-5-one, 4-[2-hydroxy-3-[(1-methylethyl)(phenylmethyl)amino]propoxy]-9-methoxy-7-methyl-, hydrochloride
| Molecular Formula | C26H30ClNO6 |
|---|---|
| Molecular Weight | 487.18 g/mol |
| LogP | 0.05 |
| Topological Polar Surface Area | 82.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 487.17618 |
| Heavy Atoms | 34 |
| Complexity | 810.0 |
Chemical Identifiers
| CAS Number | 55165-33-8 |
|---|---|
| SMILES | CC1=CC2=C(O1)C(=C3C(=C(C=CO3)OCC(C[NH+](CC4=CC=CC=C4)C(C)C)O)C2=O)OC.[Cl-] |
| InChIKey | IMHQERYPRJWDBY-UHFFFAOYSA-N |
Product Overview
RefChem:305647 (CAS 55165-33-8), with molecular formula C26H30ClNO6 and molecular weight 487.18 g/mol. IUPAC: benzyl-[2-hydroxy-3-(9-methoxy-2-methyl-4-oxofuro[3,2-g]chromen-5-yl)oxypropyl]-propan-2-ylazanium chloride.
Chemical Property Profile of RefChem:305647
Property Insights of RefChem:305647
The XLogP value of 0.05 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:305647. The TPSA of 82.6 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:305647. Following Lipinski's Rule of Five, RefChem:305647 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:305647?
The CAS number of RefChem:305647 is 55165-33-8.
What is the molecular formula of RefChem:305647?
The molecular formula of RefChem:305647 is C26H30ClNO6.
What is the molecular weight of RefChem:305647?
The molecular weight of RefChem:305647 is 487.18 g/mol.
Where can I buy RefChem:305647?
You can request a quote for RefChem:305647 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:305647?
Yes, KEHONG BIO provides custom synthesis services for RefChem:305647 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.