![2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol structure](/static/products/100/1005060-64-9.png)
2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol
TL;DR: 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol (CAS 1005060-64-9) is a chemical compound with molecular formula C22H31NO4 and molecular weight 373.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-hydroxyethyl-[3-(2,5,5-trimethyl-3,4,4a,10b-tetrahydropyrano[3,2-c]chromen-2-yl)prop-2-ynyl]amino]ethanol
Also Known As: 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol, 2,2'-{[3-(2,5,5-trimethyl-3,4,4a,10b-tetrahydro-2H,5H-pyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl]imino}diethanol, 2-[2-hydroxyethyl-[3-(2,5,5-trimethyl-3,4,4a,10b-tetrahydropyrano[3,2-c]chromen-2-yl)prop-2-ynyl]amino]ethanol
| Molecular Formula | C22H31NO4 |
|---|---|
| Molecular Weight | 373.23 g/mol |
| LogP | 2.374 |
| Topological Polar Surface Area | 62.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.2253 |
| Heavy Atoms | 27 |
| Complexity | 701.7546 |
Chemical Identifiers
| CAS Number | 1005060-64-9 |
|---|---|
| SMILES | CC1(C2CCC(OC2C3=CC=CC=C3O1)(C)C#CCN(CCO)CCO)C |
Product Overview
2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol (CAS 1005060-64-9), with molecular formula C22H31NO4 and molecular weight 373.23 g/mol. IUPAC: 2-[2-hydroxyethyl-[3-(2,5,5-trimethyl-3,4,4a,10b-tetrahydropyrano[3,2-c]chromen-2-yl)prop-2-ynyl]amino]ethanol.
Chemical Property Profile of 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol
Property Insights of 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol
The XLogP value of 2.374 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol. The TPSA of 62.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol. Following Lipinski's Rule of Five, 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol has 2 hydrogen bond donor(s) and 5 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 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol?
The CAS number of 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol is 1005060-64-9.
What is the molecular formula of 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol?
The molecular formula of 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol is C22H31NO4.
What is the molecular weight of 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol?
The molecular weight of 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol is 373.23 g/mol.
Where can I buy 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol?
You can request a quote for 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-((3-(2,5,5-trimethyl-2,3,4,4a,5,10b-hexahydropyrano[3,2-c]chromen-2-yl)prop-2-yn-1-yl)azanediyl)diethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.