![propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate structure](/static/products/859/859861-54-4.png)
propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate
TL;DR: propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate (CAS 859861-54-4) is a chemical compound with molecular formula C25H25NO5 and molecular weight 419.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-(6-oxo-2,4,7,8,9,10-hexahydroisochromeno[3,4-f][1,3]benzoxazin-3-yl)benzoate
Also Known As: propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate, propyl 4-(6-oxo-2,4,7,8,9,10-hexahydroisochromeno[3,4-f][1,3]benzoxazin-3-yl)benzoate, propyl 4-(6-oxo-7,8,9,10-tetrahydro-2H,6H-benzo[3,4]chromeno[8,7-e][1,3]oxazin-3(4H)-yl)benzoate
| Molecular Formula | C25H25NO5 |
|---|---|
| Molecular Weight | 419.17 g/mol |
| LogP | 4.5951 |
| Topological Polar Surface Area | 68.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 419.17328 |
| Heavy Atoms | 31 |
| Complexity | 1195.2433 |
Chemical Identifiers
| CAS Number | 859861-54-4 |
|---|---|
| SMILES | CCCOC(=O)C1=CC=C(C=C1)N2CC3=C(C=CC4=C3OC(=O)C5=C4CCCC5)OC2 |
Product Overview
propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate (CAS 859861-54-4), with molecular formula C25H25NO5 and molecular weight 419.17 g/mol. IUPAC: propyl 4-(6-oxo-2,4,7,8,9,10-hexahydroisochromeno[3,4-f][1,3]benzoxazin-3-yl)benzoate.
Chemical Property Profile of propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate
Property Insights of propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate
The XLogP value of 4.5951 indicates that propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.98 Ų falls within the moderate polarity range, balancing permeability and solubility for propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate. Following Lipinski's Rule of Five, propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate has 0 hydrogen bond donor(s) and 6 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 propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate?
The CAS number of propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate is 859861-54-4.
What is the molecular formula of propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate?
The molecular formula of propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate is C25H25NO5.
What is the molecular weight of propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate?
The molecular weight of propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate is 419.17 g/mol.
Where can I buy propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate?
You can request a quote for propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for propyl 4-(6-oxo-7,8,9,10-tetrahydrobenzo[3,4]chromeno[8,7-e][1,3]oxazin-3(2H,4H,6H)-yl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.