3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one
TL;DR: 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one (CAS 853894-22-1) is a chemical compound with molecular formula C21H21NO3 and molecular weight 335.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-6-ethyl-10-methyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one
Also Known As: ChemDiv3_014633, IDI1_030431, 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one, 3-benzyl-6-ethyl-10-methyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one, 3-BENZYL-6-ETHYL-10-METHYL-2H,3H,4H,8H-CHROMENO[6,7-E][1,3]OXAZIN-8-ONE
| Molecular Formula | C21H21NO3 |
|---|---|
| Molecular Weight | 335.15 g/mol |
| LogP | 4.01592 |
| Topological Polar Surface Area | 42.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 335.15213 |
| Heavy Atoms | 25 |
| Complexity | 975.838 |
Chemical Identifiers
| CAS Number | 853894-22-1 |
|---|---|
| SMILES | CCC1=CC(=O)OC2=C1C=C3CN(COC3=C2C)CC4=CC=CC=C4 |
Product Overview
3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one (CAS 853894-22-1), with molecular formula C21H21NO3 and molecular weight 335.15 g/mol. IUPAC: 3-benzyl-6-ethyl-10-methyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-8-one.
Chemical Property Profile of 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one
Property Insights of 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one
The XLogP value of 4.01592 indicates that 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.68 Ų, 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one has 0 hydrogen bond donor(s) and 4 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 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one?
The CAS number of 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one is 853894-22-1.
What is the molecular formula of 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one?
The molecular formula of 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one is C21H21NO3.
What is the molecular weight of 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one?
The molecular weight of 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one is 335.15 g/mol.
Where can I buy 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one?
You can request a quote for 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-benzyl-6-ethyl-10-methyl-3,4-dihydrochromeno[6,7-e][1,3]oxazin-8(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.