PGD2甲酯
TL;DR: PGD2甲酯 (CAS 49852-81-5) is a chemical compound with molecular formula C21H34O5 and molecular weight 366.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
PGD2甲酯
methyl 7-[(1R,2R,5S)-5-hydroxy-2-[(3S)-3-hydroxyoct-1-enyl]-3-oxocyclopentyl]hept-5-enoate
Also Known As: Pgd2 methyl ester, Pgd2 Me, Prostaglandin D2 methyl ester, Methyl 7-[(1R,2R,5S)-5-hydroxy-2-[(3S)-3-hydroxyoct-1-enyl]-3-oxocyclopentyl]hept-5-enoate, Prosta-5,13-dien-1-oic acid, 9,15-dihydroxy-11-oxo-, methyl ester, (5Z,9alpha,13E,15S)-
| Molecular Formula | C21H34O5 |
|---|---|
| Molecular Weight | 366.24 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 366.24063 |
| Heavy Atoms | 26 |
| Complexity | 483.0 |
Chemical Identifiers
| CAS Number | 49852-81-5 |
|---|---|
| SMILES | CCCCC[C@@H](C=C[C@@H]1[C@H]([C@H](CC1=O)O)CC=CCCCC(=O)OC)O |
| InChIKey | WNBMQMMGBBWUOZ-MANSERQUSA-N |
Product Overview
PGD2甲酯 (CAS 49852-81-5), with molecular formula C21H34O5 and molecular weight 366.24 g/mol. IUPAC: methyl 7-[(1R,2R,5S)-5-hydroxy-2-[(3S)-3-hydroxyoct-1-enyl]-3-oxocyclopentyl]hept-5-enoate.
Chemical Property Profile of PGD2甲酯
Property Insights of PGD2甲酯
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for PGD2甲酯. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for PGD2甲酯. Following Lipinski's Rule of Five, PGD2甲酯 has 2 hydrogen bond donor(s) and 5 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 PGD2甲酯?
The CAS number of PGD2甲酯 is 49852-81-5.
What is the molecular formula of PGD2甲酯?
The molecular formula of PGD2甲酯 is C21H34O5.
What is the molecular weight of PGD2甲酯?
The molecular weight of PGD2甲酯 is 366.24 g/mol.
Where can I buy PGD2甲酯?
You can request a quote for PGD2甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for PGD2甲酯?
Yes, KEHONG BIO provides custom synthesis services for PGD2甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.