ZK 114043
TL;DR: ZK 114043 (CAS 105120-95-4) is a chemical compound with molecular formula C29H34O4 and molecular weight 446.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,11R,13S,14S,17S)-11-(4-acetylphenyl)-17-hydroxy-17-[(E)-3-hydroxyprop-1-enyl]-13-methyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
Also Known As: ZK 114043, ZK 114.043, (8S,11R,13S,14S,17S)-11-(4-acetylphenyl)-17-hydroxy-17-[(E)-3-hydroxyprop-1-enyl]-13-methyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one, (11beta,17beta)-11-(4-Acetylphenyl)-17-hydroxy-17-(3-hydroxy-1-propenyl)estra-4,9-dien-3-one, Estra-4,9-dien-3-one, 11-(4-acetylphenyl)-17-hydroxy-17-(3-hydroxy-1-propenyl)-, (11beta,17beta)-
| Molecular Formula | C29H34O4 |
|---|---|
| Molecular Weight | 446.25 g/mol |
| LogP | 5.0683 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 446.2457 |
| Heavy Atoms | 33 |
| Complexity | 1075.344 |
Chemical Identifiers
| CAS Number | 105120-95-4 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)[C@H]2C[C@]3([C@@H](CC[C@@]3(/C=C/CO)O)[C@H]4C2=C5CCC(=O)C=C5CC4)C |
Product Overview
ZK 114043 (CAS 105120-95-4), with molecular formula C29H34O4 and molecular weight 446.25 g/mol. IUPAC: (8S,11R,13S,14S,17S)-11-(4-acetylphenyl)-17-hydroxy-17-[(E)-3-hydroxyprop-1-enyl]-13-methyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of ZK 114043
Property Insights of ZK 114043
The XLogP value of 5.0683 indicates that ZK 114043 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for ZK 114043. Following Lipinski's Rule of Five, ZK 114043 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ZK 114043?
The CAS number of ZK 114043 is 105120-95-4.
What is the molecular formula of ZK 114043?
The molecular formula of ZK 114043 is C29H34O4.
What is the molecular weight of ZK 114043?
The molecular weight of ZK 114043 is 446.25 g/mol.
Where can I buy ZK 114043?
You can request a quote for ZK 114043 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ZK 114043?
Yes, KEHONG BIO provides custom synthesis services for ZK 114043 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.