Ono-AE1-437
TL;DR: Ono-AE1-437 (CAS 256382-23-7) is a chemical compound with molecular formula C23H32O6S and molecular weight 436.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxy-4-[3-(methoxymethyl)phenyl]but-1-enyl]-5-oxocyclopentyl]ethylsulfanyl]butanoic acid
Also Known As: Rivenprost free acid, ONO-AE1-437, J1.579.029F, 4-[[2-[(1R,2R,3R)-3-Hydroxy-2-[(1E,3S)-3-hydroxy-4-[3-(methoxymethyl)phenyl]-1-buten-1-yl]-5-oxocyclopentyl]ethyl]thio]butanoic acid, 16-[3-(Methoxymethyl)phenyl]-5-thia-17,18,19,20-tetranorprostaglandin E1
| Molecular Formula | C23H32O6S |
|---|---|
| Molecular Weight | 436.19 g/mol |
| LogP | 2.8468 |
| Topological Polar Surface Area | 104.06 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 436.19196 |
| Heavy Atoms | 30 |
| Complexity | 719.3998 |
Chemical Identifiers
| CAS Number | 256382-23-7 |
|---|---|
| SMILES | COCC1=CC=CC(=C1)C[C@@H](/C=C/[C@H]2[C@@H](CC(=O)[C@@H]2CCSCCCC(=O)O)O)O |
Product Overview
Ono-AE1-437 (CAS 256382-23-7), with molecular formula C23H32O6S and molecular weight 436.19 g/mol. IUPAC: 4-[2-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxy-4-[3-(methoxymethyl)phenyl]but-1-enyl]-5-oxocyclopentyl]ethylsulfanyl]butanoic acid.
Chemical Property Profile of Ono-AE1-437
Property Insights of Ono-AE1-437
The XLogP value of 2.8468 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ono-AE1-437. The TPSA of 104.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Ono-AE1-437. Following Lipinski's Rule of Five, Ono-AE1-437 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 Ono-AE1-437?
The CAS number of Ono-AE1-437 is 256382-23-7.
What is the molecular formula of Ono-AE1-437?
The molecular formula of Ono-AE1-437 is C23H32O6S.
What is the molecular weight of Ono-AE1-437?
The molecular weight of Ono-AE1-437 is 436.19 g/mol.
Where can I buy Ono-AE1-437?
You can request a quote for Ono-AE1-437 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ono-AE1-437?
Yes, KEHONG BIO provides custom synthesis services for Ono-AE1-437 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.