Homoisocarbacyclin
TL;DR: Homoisocarbacyclin (CAS 130377-59-2) is a chemical compound with molecular formula C26H36O5 and molecular weight 428.2563 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[(1S,2S,3aR,7aR)-2-hydroxy-1-[(E,3R)-3-hydroxy-4-methyl-4-phenoxypent-1-enyl]-2,3,3a,6,7,7a-hexahydro-1H-inden-5-yl]pentanoic acid
Also Known As: Homoisocarbacyclin, 5-[(1S,2S,3aR,7aR)-2-hydroxy-1-[(E,3R)-3-hydroxy-4-methyl-4-phenoxypent-1-enyl]-2,3,3a,6,7,7a-hexahydro-1H-inden-5-yl]pentanoic acid, 1H-Indene-5-pentanoic acid, 2,3,3a,6,7,7a-hexahydro-2-hydroxy-1-(3-hydroxy-4-methyl-4-phenoxy-1-pentenyl)-, (1S-(1alpha(1E,3S*),2beta,3aalpha,7aalpha))-
Technical Specifications
| Molecular Formula | C26H36O5 |
| Molecular Weight | 428.2563 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 87.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 428.2563 Da |
| Heavy Atoms | 31 |
| Complexity | 646.0 |
| SMILES | CC(C)([C@@H](/C=C/[C@H]1[C@@H]2CCC(=C[C@@H]2C[C@@H]1O)CCCCC(=O)O)O)OC3=CC=CC=C3 |
| InChIKey | APARNMGVZWWLMV-ZEYCUZRTSA-N |
Chemical Property Profile of Homoisocarbacyclin
Property Insights of Homoisocarbacyclin
The XLogP value of 3.9 indicates that Homoisocarbacyclin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Homoisocarbacyclin. Following Lipinski's Rule of Five, Homoisocarbacyclin has 3 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 Homoisocarbacyclin?
The CAS number of Homoisocarbacyclin is 130377-59-2.
What is the molecular formula of Homoisocarbacyclin?
The molecular formula of Homoisocarbacyclin is C26H36O5.
What is the molecular weight of Homoisocarbacyclin?
The molecular weight of Homoisocarbacyclin is 428.2563 g/mol.
Where can I buy Homoisocarbacyclin?
You can request a quote for Homoisocarbacyclin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Homoisocarbacyclin?
Yes, CoreyChem provides custom synthesis services for Homoisocarbacyclin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.