Conophylline
TL;DR: Conophylline (CAS 142741-24-0) is a chemical compound with molecular formula C44H50N4O10 and molecular weight 794.3527 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl 14,25-diethyl-24,33-dihydroxy-31,32-dimethoxy-12,22-dioxa-1,9,18,29-tetrazadodecacyclo[23.13.1.16,9.02,23.03,21.05,19.06,17.011,13.028,36.030,35.036,39.014,40]tetraconta-3,5(19),16,20,27,30,32,34-octaene-16,27-dicarboxylate
Also Known As: Conophylline, B0005-166147, Dimethyl 14,25-diethyl-24,33-dihydroxy-31,32-dimethoxy-12,22-dioxa-1,9,18,29-tetrazadodecacyclo[23.13.1.16,9.02,23.03,21.05,19.06,17.011,13.028,36.030,35.036,39.014,40]tetraconta-3,5(19),16,20,27,30,32,34-octaene-16,27-dicarboxylate, CID 9853848, G16649
Technical Specifications
| Molecular Formula | C44H50N4O10 |
| Molecular Weight | 794.3527 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 164.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 8 |
| Exact Mass | 794.3527 Da |
| Heavy Atoms | 58 |
| Complexity | 1890.0 |
| SMILES | CCC12CC(=C3C4(C1N(CC4)C5C(C2O)OC6=CC7=C(C=C56)C89CCN1C8C(CC(=C9N7)C(=O)OC)(C2C(C1)O2)CC)C1=CC(=C(C(=C1N3)OC)OC)O)C(=O)OC |
| InChIKey | QZRIMAMDGWAHPQ-UHFFFAOYSA-N |
Chemical Property Profile of Conophylline
Property Insights of Conophylline
The XLogP value of 3.7 indicates that Conophylline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 164.0 Ų indicates high polarity, suggesting Conophylline may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Conophylline has 4 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Conophylline?
The CAS number of Conophylline is 142741-24-0.
What is the molecular formula of Conophylline?
The molecular formula of Conophylline is C44H50N4O10.
What is the molecular weight of Conophylline?
The molecular weight of Conophylline is 794.3527 g/mol.
Where can I buy Conophylline?
You can request a quote for Conophylline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Conophylline?
Yes, CoreyChem provides custom synthesis services for Conophylline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.