Iodovulone I
TL;DR: Iodovulone I (CAS 105343-03-1) is a chemical compound with molecular formula C21H29IO4 and molecular weight 472.11105 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (Z,7E)-7-[(2R)-2-hydroxy-4-iodo-2-[(Z)-oct-2-enyl]-5-oxocyclopent-3-en-1-ylidene]hept-5-enoate
Also Known As: iodovulone I, J1.642.196K, methyl 9-oxo-10-iodo-12R-hydroxy-5Z,7E,10Z,13Z-prostatetraenoate-cyclo[8,12], methyl (Z,7E)-7-[(2R)-2-hydroxy-4-iodo-2-[(Z)-oct-2-enyl]-5-oxocyclopent-3-en-1-ylidene]hept-5-enoate, methyl 9-oxo-10-iodo-12R-hydroxy-5Z,7E,10Z,13Z-prostatetraenoate-cyclo(8,12)
Technical Specifications
| Molecular Formula | C21H29IO4 |
| Molecular Weight | 472.11105 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 472.11105 Da |
| Heavy Atoms | 26 |
| Complexity | 601.0 |
| SMILES | CCCCC/C=C\C[C@]\1(C=C(C(=O)/C1=C/C=C\CCCC(=O)OC)I)O |
| InChIKey | WBVIHDHLOOPYQN-DJKWDOPVSA-N |
Chemical Property Profile of Iodovulone I
Property Insights of Iodovulone I
The XLogP value of 4.9 indicates that Iodovulone I is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Iodovulone I. Following Lipinski's Rule of Five, Iodovulone I has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Iodovulone I?
The CAS number of Iodovulone I is 105343-03-1.
What is the molecular formula of Iodovulone I?
The molecular formula of Iodovulone I is C21H29IO4.
What is the molecular weight of Iodovulone I?
The molecular weight of Iodovulone I is 472.11105 g/mol.
Where can I buy Iodovulone I?
You can request a quote for Iodovulone I directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Iodovulone I?
Yes, CoreyChem provides custom synthesis services for Iodovulone I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.