2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)-
TL;DR: 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)- (CAS 135420-29-0) is a chemical compound with molecular formula C19H27NO3 and molecular weight 317.1991 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-butanoyl-4-hexyl-2-methyl-1,4-benzoxazin-3-one
Also Known As: 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)-, 4-Hexyl-2-methyl-7-(1-oxobutyl)-2H-1,4-benzoxazin-3(4H)-one, 7-butanoyl-4-hexyl-2-methyl-1,4-benzoxazin-3-one, 4-Hexyl-2-methyl-7-butyryl-4H-1,4-benzoxazin-3(2H)-one, 7-Butanoyl-4-hexyl-2-methyl-2H-1,4-benzoxazin-3(4H)-one
Technical Specifications
| Molecular Formula | C19H27NO3 |
| Molecular Weight | 317.1991 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 317.1991 Da |
| Heavy Atoms | 23 |
| Complexity | 409.0 |
| SMILES | CCCCCCN1C2=C(C=C(C=C2)C(=O)CCC)OC(C1=O)C |
| InChIKey | HPKQBTYUUOVNPX-UHFFFAOYSA-N |
Chemical Property Profile of 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)-
Property Insights of 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)-
The XLogP value of 4.3 indicates that 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.6 Ų, 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)-?
The CAS number of 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)- is 135420-29-0.
What is the molecular formula of 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)-?
The molecular formula of 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)- is C19H27NO3.
What is the molecular weight of 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)-?
The molecular weight of 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)- is 317.1991 g/mol.
Where can I buy 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)-?
You can request a quote for 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)-?
Yes, CoreyChem provides custom synthesis services for 2H-1,4-Benzoxazin-3(4H)-one, 4-hexyl-2-methyl-7-(1-oxobutyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.