![9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one structure](/static/products/859/859862-91-2.png)
9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one
TL;DR: 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one (CAS 859862-91-2) is a chemical compound with molecular formula C21H19NO5 and molecular weight 365.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(1,3-benzodioxol-5-ylmethyl)-4-ethyl-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-2-one
Also Known As: 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one, 9-(1,3-benzodioxol-5-ylmethyl)-4-ethyl-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-2-one, 9-(1,3-benzodioxol-5-ylmethyl)-4-ethyl-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one, 9-[(2H-1,3-BENZODIOXOL-5-YL)METHYL]-4-ETHYL-2H,8H,9H,10H-CHROMENO[8,7-E][1,3]OXAZIN-2-ONE
| Molecular Formula | C21H19NO5 |
|---|---|
| Molecular Weight | 365.13 g/mol |
| LogP | 3.4362 |
| Topological Polar Surface Area | 61.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 365.1263 |
| Heavy Atoms | 27 |
| Complexity | 1087.8575 |
Chemical Identifiers
| CAS Number | 859862-91-2 |
|---|---|
| SMILES | CCC1=CC(=O)OC2=C1C=CC3=C2CN(CO3)CC4=CC5=C(C=C4)OCO5 |
Product Overview
9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one (CAS 859862-91-2), with molecular formula C21H19NO5 and molecular weight 365.13 g/mol. IUPAC: 9-(1,3-benzodioxol-5-ylmethyl)-4-ethyl-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-2-one.
Chemical Property Profile of 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one
Property Insights of 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one
The XLogP value of 3.4362 indicates that 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one. Following Lipinski's Rule of Five, 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one 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 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one?
The CAS number of 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one is 859862-91-2.
What is the molecular formula of 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one?
The molecular formula of 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one is C21H19NO5.
What is the molecular weight of 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one?
The molecular weight of 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one is 365.13 g/mol.
Where can I buy 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one?
You can request a quote for 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one?
Yes, KEHONG BIO provides custom synthesis services for 9-(benzo[d][1,3]dioxol-5-ylmethyl)-4-ethyl-9,10-dihydrochromeno[8,7-e][1,3]oxazin-2(8H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.