RefChem:267560
TL;DR: RefChem:267560 (CAS 57802-44-5) is a chemical compound with molecular formula C20H29NO6 and molecular weight 379.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(diethylamino)ethoxy]-4-hydroxy-3,3-dimethyl-2,4-dihydropyrano[2,3-g]chromen-7-one;hydrate
Also Known As: 3'-Hydroxy-4'-(beta-diethylaminoethoxy)-3',4'-dihydroseselin hydrate, 2H,8H-Benzo(1,2-b:3,4-b')dipyran-2-one, 9,10-dihydro-10-(2-(diethylamino)ethoxy)-8,8-dimethyl-9-hydroxy-, hydrate, 10-[2-(Diethylamino)ethoxy]-9-hydroxy-8,8-dimethyl-8,9-dihydrobenzo[1,2-b:4,5-b']dipyran-2(7H)-one--water (1/1), 5-(2-diethylaminoethyloxy)-4-hydroxy-3,3-dimethyl-2,4-dihydropyrano[2,3-g]chromen-7-one hydrate, RefChem:267560
| Molecular Formula | C20H29NO6 |
|---|---|
| Molecular Weight | 379.20 g/mol |
| LogP | 2.14 |
| Topological Polar Surface Area | 69.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 379.1995 |
| Heavy Atoms | 27 |
| Complexity | 530.0 |
Chemical Identifiers
| CAS Number | 57802-44-5 |
|---|---|
| SMILES | CCN(CC)CCOC1=C2C(=CC3=C1C(C(CO3)(C)C)O)C=CC(=O)O2.O |
| InChIKey | ZJYUNBOMNSHGRP-UHFFFAOYSA-N |
Product Overview
RefChem:267560 (CAS 57802-44-5), with molecular formula C20H29NO6 and molecular weight 379.20 g/mol. IUPAC: 5-[2-(diethylamino)ethoxy]-4-hydroxy-3,3-dimethyl-2,4-dihydropyrano[2,3-g]chromen-7-one;hydrate.
Chemical Property Profile of RefChem:267560
Property Insights of RefChem:267560
The XLogP value of 2.14 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:267560. The TPSA of 69.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:267560. Following Lipinski's Rule of Five, RefChem:267560 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:267560?
The CAS number of RefChem:267560 is 57802-44-5.
What is the molecular formula of RefChem:267560?
The molecular formula of RefChem:267560 is C20H29NO6.
What is the molecular weight of RefChem:267560?
The molecular weight of RefChem:267560 is 379.20 g/mol.
Where can I buy RefChem:267560?
You can request a quote for RefChem:267560 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:267560?
Yes, KEHONG BIO provides custom synthesis services for RefChem:267560 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.