KST-1A4223
TL;DR: KST-1A4223 (CAS 36155-78-9) is a chemical compound with molecular formula C29H32ClNO2 and molecular weight 461.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S)-3-(4-chlorophenyl)-1-phenyl-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pentan-1-one
Also Known As: KST-1A4223, erythro-3-(p-Chlorophenyl)-2-(p-(2-(1-pyrrolidinyl)ethoxy)phenyl)valerophenone, (2r,3s)-3-(4-chlorophenyl)-1-phenyl-2-{4-[2-(pyrrolidin-1-yl)ethoxy]phenyl}pentan-1-one, Valerophenone, 3-(p-chlorophenyl)-2-(p-(2-(1-pyrrolidinyl)ethoxy)phenyl)-, erythro-, (2R,3S)-3-(4-chlorophenyl)-1-phenyl-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pentan-1-one
| Molecular Formula | C29H32ClNO2 |
|---|---|
| Molecular Weight | 461.21 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 461.21216 |
| Heavy Atoms | 33 |
| Complexity | 570.0 |
Chemical Identifiers
| CAS Number | 36155-78-9 |
|---|---|
| SMILES | CC[C@H](C1=CC=C(C=C1)Cl)[C@H](C2=CC=C(C=C2)OCCN3CCCC3)C(=O)C4=CC=CC=C4 |
| InChIKey | MYOLTGUMBFWBFE-IZLXSDGUSA-N |
Product Overview
KST-1A4223 (CAS 36155-78-9), with molecular formula C29H32ClNO2 and molecular weight 461.21 g/mol. IUPAC: (2R,3S)-3-(4-chlorophenyl)-1-phenyl-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pentan-1-one.
Chemical Property Profile of KST-1A4223
Property Insights of KST-1A4223
The XLogP value of 7.2 indicates that KST-1A4223 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, KST-1A4223 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KST-1A4223 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of KST-1A4223?
The CAS number of KST-1A4223 is 36155-78-9.
What is the molecular formula of KST-1A4223?
The molecular formula of KST-1A4223 is C29H32ClNO2.
What is the molecular weight of KST-1A4223?
The molecular weight of KST-1A4223 is 461.21 g/mol.
Where can I buy KST-1A4223?
You can request a quote for KST-1A4223 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A4223?
Yes, KEHONG BIO provides custom synthesis services for KST-1A4223 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.