Clostilbegit
TL;DR: Clostilbegit (CAS 50-41-9) is a chemical compound with molecular formula C32H36ClNO8 and molecular weight 597.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2-chloro-1,2-diphenylethenyl)phenoxy]-N,N-diethylethanamine;2-hydroxypropane-1,2,3-tricarboxylic acid
Also Known As: CLOMIPHENE CITRATE, Clomifene citrate, Clostilbegyt, Clomid, Chloramiphene
| Molecular Formula | C32H36ClNO8 |
|---|---|
| Molecular Weight | 597.21 g/mol |
| LogP | 5.31 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 14 |
| Exact Mass | 597.21295 |
| Heavy Atoms | 42 |
| Complexity | 708.0 |
Chemical Identifiers
| CAS Number | 50-41-9 |
|---|---|
| SMILES | CCN(CC)CCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Cl)C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
| InChIKey | PYTMYKVIJXPNBD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Clostilbegit (CAS 50-41-9), with molecular formula C32H36ClNO8 and molecular weight 597.21 g/mol. IUPAC: 2-[4-(2-chloro-1,2-diphenylethenyl)phenoxy]-N,N-diethylethanamine;2-hydroxypropane-1,2,3-tricarboxylic acid.
Chemical Property Profile of Clostilbegit
Property Insights of Clostilbegit
The XLogP value of 5.31 indicates that Clostilbegit is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 145.0 Ų indicates high polarity, suggesting Clostilbegit may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Clostilbegit has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Clostilbegit?
The CAS number of Clostilbegit is 50-41-9.
What is the molecular formula of Clostilbegit?
The molecular formula of Clostilbegit is C32H36ClNO8.
What is the molecular weight of Clostilbegit?
The molecular weight of Clostilbegit is 597.21 g/mol.
Where can I buy Clostilbegit?
You can request a quote for Clostilbegit directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Clostilbegit?
Yes, KEHONG BIO provides custom synthesis services for Clostilbegit and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.