![butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate structure](/static/products/859/859107-75-8.png)
butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate
TL;DR: butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate (CAS 859107-75-8) is a chemical compound with molecular formula C29H27NO6 and molecular weight 485.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 4-[4-(4-methoxyphenyl)-2-oxo-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-9-yl]benzoate
Also Known As: butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate, butyl 4-[4-(4-methoxyphenyl)-2-oxo-2H,8H-chromeno[8,7-e][1,3]oxazin-9(10H)-yl]benzoate, butyl 4-[4-(4-methoxyphenyl)-2-oxo-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-9-yl]benzoate
| Molecular Formula | C29H27NO6 |
|---|---|
| Molecular Weight | 485.18 g/mol |
| LogP | 5.782 |
| Topological Polar Surface Area | 78.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 485.18384 |
| Heavy Atoms | 36 |
| Complexity | 1440.1064 |
Chemical Identifiers
| CAS Number | 859107-75-8 |
|---|---|
| SMILES | CCCCOC(=O)C1=CC=C(C=C1)N2CC3=C(C=CC4=C3OC(=O)C=C4C5=CC=C(C=C5)OC)OC2 |
Product Overview
butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate (CAS 859107-75-8), with molecular formula C29H27NO6 and molecular weight 485.18 g/mol. IUPAC: butyl 4-[4-(4-methoxyphenyl)-2-oxo-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-9-yl]benzoate.
Chemical Property Profile of butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate
Property Insights of butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate
The XLogP value of 5.782 indicates that butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.21 Ų falls within the moderate polarity range, balancing permeability and solubility for butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate. Following Lipinski's Rule of Five, butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate?
The CAS number of butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate is 859107-75-8.
What is the molecular formula of butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate?
The molecular formula of butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate is C29H27NO6.
What is the molecular weight of butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate?
The molecular weight of butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate is 485.18 g/mol.
Where can I buy butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate?
You can request a quote for butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for butyl 4-(4-(4-methoxyphenyl)-2-oxochromeno[8,7-e][1,3]oxazin-9(2H,8H,10H)-yl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.