15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1
TL;DR: 15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1 (CAS 83009-96-5) is a chemical compound with molecular formula C21H34O5S and molecular weight 398.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-[(1R,2S,3R)-2-[(E)-3-cyclohexyl-3-hydroxyprop-1-enyl]-3-hydroxy-5-oxocyclopentyl]sulfanylhexanoate
Also Known As: Cpt-PGE1, 15-Cyclohexyl-omega-pentanor-7-thiaprostaglandin E1, methyl 6-[(1R,2S,3R)-2-[(E)-3-cyclohexyl-3-hydroxyprop-1-enyl]-3-hydroxy-5-oxocyclopentyl]sulfanylhexanoate, 15-Cyclohexyl-16,17,18,19,20-pentanor-7-thiaprostaglandin E1 methyl ester, [1R-[1alpha,2beta(1E,3S*),3alpha]]-6-[[2-(3-Cyclohexyl-3-hydroxy-1-propenyl)-3-hydroxy-5-oxocyclopentyl]thio]hexanoic acid methyl ester
| Molecular Formula | C21H34O5S |
|---|---|
| Molecular Weight | 398.21 g/mol |
| LogP | 3.2689 |
| Topological Polar Surface Area | 83.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 398.2127 |
| Heavy Atoms | 27 |
| Complexity | 500.80045 |
Chemical Identifiers
| CAS Number | 83009-96-5 |
|---|---|
| SMILES | COC(=O)CCCCCS[C@@H]1[C@H]([C@@H](CC1=O)O)/C=C/C(C2CCCCC2)O |
Product Overview
15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1 (CAS 83009-96-5), with molecular formula C21H34O5S and molecular weight 398.21 g/mol. IUPAC: methyl 6-[(1R,2S,3R)-2-[(E)-3-cyclohexyl-3-hydroxyprop-1-enyl]-3-hydroxy-5-oxocyclopentyl]sulfanylhexanoate.
Chemical Property Profile of 15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1
Property Insights of 15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1
The XLogP value of 3.2689 indicates that 15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1. Following Lipinski's Rule of Five, 15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1 has 2 hydrogen bond donor(s) and 6 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 15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1?
The CAS number of 15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1 is 83009-96-5.
What is the molecular formula of 15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1?
The molecular formula of 15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1 is C21H34O5S.
What is the molecular weight of 15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1?
The molecular weight of 15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1 is 398.21 g/mol.
Where can I buy 15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1?
You can request a quote for 15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1?
Yes, KEHONG BIO provides custom synthesis services for 15-cyclohexyl-omega-pentanor-7-thiaprostaglandin E1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.