![1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one structure](/static/products/304/30487-73-1.png)
1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one
TL;DR: 1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one (CAS 30487-73-1) is a chemical compound with molecular formula C15H23N3O4 and molecular weight 309.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-butyl-5-[(2-oxoazepan-1-yl)methyl]-1,3-diazinane-2,4,6-trione
Also Known As: 5-butyl-5-[(2-oxoazepan-1-yl)methyl]-1,3-diazinane-2,4,6-trione, 5-butyl-5-((2-oxoazepan-1-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione, 1-[(5-butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one
| Molecular Formula | C15H23N3O4 |
|---|---|
| Molecular Weight | 309.17 g/mol |
| LogP | 0.9316 |
| Topological Polar Surface Area | 95.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 309.16885 |
| Heavy Atoms | 22 |
| Complexity | 469.17923 |
Chemical Identifiers
| CAS Number | 30487-73-1 |
|---|---|
| SMILES | CCCCC1(C(=O)NC(=O)NC1=O)CN2CCCCCC2=O |
Product Overview
1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one (CAS 30487-73-1), with molecular formula C15H23N3O4 and molecular weight 309.17 g/mol. IUPAC: 5-butyl-5-[(2-oxoazepan-1-yl)methyl]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one
Property Insights of 1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one
The XLogP value of 0.9316 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one. The TPSA of 95.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one. Following Lipinski's Rule of Five, 1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one has 2 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 1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one?
The CAS number of 1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one is 30487-73-1.
What is the molecular formula of 1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one?
The molecular formula of 1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one is C15H23N3O4.
What is the molecular weight of 1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one?
The molecular weight of 1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one is 309.17 g/mol.
Where can I buy 1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one?
You can request a quote for 1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[(5-Butyl-2,6-dihydroxy-4-oxo-4,5-dihydropyrimidin-5-yl)methyl]azepan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.