1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde
TL;DR: 1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde (CAS 887576-73-0) is a chemical compound with molecular formula C14H20N2O3 and molecular weight 264.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclooctyl-6-methyl-2,4-dioxopyrimidine-5-carbaldehyde
Also Known As: 1-cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde, AJ-030/12105417, 1-cyclooctyl-6-methyl-2,4-dioxopyrimidine-5-carbaldehyde, 3-cyclooctyl-4-methyl-2,6-dioxo-1,3-dihydropyrimidine-5-carbaldehyde
| Molecular Formula | C14H20N2O3 |
|---|---|
| Molecular Weight | 264.15 g/mol |
| LogP | 1.94292 |
| Topological Polar Surface Area | 71.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 264.1474 |
| Heavy Atoms | 19 |
| Complexity | 563.0343 |
Chemical Identifiers
| CAS Number | 887576-73-0 |
|---|---|
| SMILES | CC1=C(C(=O)NC(=O)N1C2CCCCCCC2)C=O |
Product Overview
1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde (CAS 887576-73-0), with molecular formula C14H20N2O3 and molecular weight 264.15 g/mol. IUPAC: 1-cyclooctyl-6-methyl-2,4-dioxopyrimidine-5-carbaldehyde.
Chemical Property Profile of 1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde
Property Insights of 1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde
The XLogP value of 1.94292 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde. The TPSA of 71.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde. Following Lipinski's Rule of Five, 1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde has 1 hydrogen bond donor(s) and 3 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-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde?
The CAS number of 1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde is 887576-73-0.
What is the molecular formula of 1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde?
The molecular formula of 1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde is C14H20N2O3.
What is the molecular weight of 1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde?
The molecular weight of 1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde is 264.15 g/mol.
Where can I buy 1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde?
You can request a quote for 1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 1-Cyclooctyl-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.