(2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate
TL;DR: (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate (CAS 1427794-25-9) is a chemical compound with molecular formula C25H25NO5 and molecular weight 419.17328 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl] 9,10-dioxoanthracene-1-carboxylate
Also Known As: (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate, [2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl] 9,10-dioxoanthracene-1-carboxylate, [2-[[(1R,2R,3R)-2,3-dimethylcyclohexyl]amino]-2-oxoethyl] 9,10-dioxoanthracene-1-carboxylate
Technical Specifications
| Molecular Formula | C25H25NO5 |
| Molecular Weight | 419.17328 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 89.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 419.17328 Da |
| Heavy Atoms | 31 |
| Complexity | 733.0 |
| SMILES | CC1CCCC(C1C)NC(=O)COC(=O)C2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O |
| InChIKey | AVGZDESZBKNBEP-UHFFFAOYSA-N |
Chemical Property Profile of (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate
Property Insights of (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate
The XLogP value of 4.7 indicates that (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate. Following Lipinski's Rule of Five, (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate?
The CAS number of (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate is 1427794-25-9.
What is the molecular formula of (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate?
The molecular formula of (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate is C25H25NO5.
What is the molecular weight of (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate?
The molecular weight of (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate is 419.17328 g/mol.
Where can I buy (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate?
You can request a quote for (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate?
Yes, CoreyChem provides custom synthesis services for (2,3-dimethylcyclohexyl)carbamoylmethyl 9,10-dioxoanthracene-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.