Delprostenate
TL;DR: Delprostenate (CAS 68399-12-2) is a chemical compound with molecular formula C23H29ClO6 and molecular weight 436.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2E,5E)-7-[(2R)-2-[(E,3R)-4-(3-chlorophenoxy)-3-hydroxybut-1-enyl]-3,5-dihydroxycyclopentyl]hepta-2,5-dienoate
Also Known As: Delprostenate, 2,5-Heptadienoic acid, 7-(2-(4-(3-chlorophenoxy)-3-hydroxy-1-butenyl)-3,5- dihydroxycyclopentyl)-, methyl ester, (1R-(1-alpha(2E,5E),2-beta(1E,3R*),3-alpha,5-alpha))-, 2,5-Heptadienoic acid, 7-(2-(4-(3-chlorophenoxy)-3-hydroxy-1-butenyl)-3,5-dihydroxycyclopentyl)-, methyl ester, (1R-(1-alpha(2E,5E),2-beta(1E,3R*),3-alpha,5-alpha))-, methyl (2E,5E)-7-[(2R)-2-[(E,3R)-4-(3-chlorophenoxy)-3-hydroxybut-1-enyl]-3,5-dihydroxycyclopentyl]hepta-2,5-dienoate
| Molecular Formula | C23H29ClO6 |
|---|---|
| Molecular Weight | 436.17 g/mol |
| LogP | 3.0594 |
| Topological Polar Surface Area | 96.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 436.16525 |
| Heavy Atoms | 30 |
| Complexity | 759.8151 |
Chemical Identifiers
| CAS Number | 68399-12-2 |
|---|---|
| SMILES | COC(=O)/C=C/C/C=C/CC1[C@H](C(CC1O)O)/C=C/[C@H](COC2=CC(=CC=C2)Cl)O |
Product Overview
Delprostenate (CAS 68399-12-2), with molecular formula C23H29ClO6 and molecular weight 436.17 g/mol. IUPAC: methyl (2E,5E)-7-[(2R)-2-[(E,3R)-4-(3-chlorophenoxy)-3-hydroxybut-1-enyl]-3,5-dihydroxycyclopentyl]hepta-2,5-dienoate.
Chemical Property Profile of Delprostenate
Property Insights of Delprostenate
The XLogP value of 3.0594 indicates that Delprostenate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Delprostenate. Following Lipinski's Rule of Five, Delprostenate has 3 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 Delprostenate?
The CAS number of Delprostenate is 68399-12-2.
What is the molecular formula of Delprostenate?
The molecular formula of Delprostenate is C23H29ClO6.
What is the molecular weight of Delprostenate?
The molecular weight of Delprostenate is 436.17 g/mol.
Where can I buy Delprostenate?
You can request a quote for Delprostenate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Delprostenate?
Yes, KEHONG BIO provides custom synthesis services for Delprostenate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.