卡巴前列环素
TL;DR: 卡巴前列环素 (CAS 69552-46-1) is a chemical compound with molecular formula C21H34O4 and molecular weight 350.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
卡巴前列环素
5-[5-hydroxy-4-(3-hydroxyoct-1-enyl)-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]pentanoic acid
Also Known As: carbacyclin, Carboprostacyclin, Carbacycline, Carbaprostacyclin, Carba pgx
| Molecular Formula | C21H34O4 |
|---|---|
| Molecular Weight | 350.25 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 350.2457 |
| Heavy Atoms | 25 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 69552-46-1 |
|---|---|
| SMILES | CCCCCC(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O |
| InChIKey | XZFRIPGNUQRGPI-UHFFFAOYSA-N |
Product Overview
卡巴前列环素 (CAS 69552-46-1), with molecular formula C21H34O4 and molecular weight 350.25 g/mol. IUPAC: 5-[5-hydroxy-4-(3-hydroxyoct-1-enyl)-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]pentanoic acid.
Chemical Property Profile of 卡巴前列环素
Property Insights of 卡巴前列环素
The XLogP value of 3.2 indicates that 卡巴前列环素 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 卡巴前列环素. Following Lipinski's Rule of Five, 卡巴前列环素 has 3 hydrogen bond donor(s) and 4 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 卡巴前列环素?
The CAS number of 卡巴前列环素 is 69552-46-1.
What is the molecular formula of 卡巴前列环素?
The molecular formula of 卡巴前列环素 is C21H34O4.
What is the molecular weight of 卡巴前列环素?
The molecular weight of 卡巴前列环素 is 350.25 g/mol.
Where can I buy 卡巴前列环素?
You can request a quote for 卡巴前列环素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 卡巴前列环素?
Yes, KEHONG BIO provides custom synthesis services for 卡巴前列环素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.