EP 092
TL;DR: EP 092 (CAS 96384-09-7) is a chemical compound with molecular formula C23H31N3O2S and molecular weight 413.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-7-[(1R,2R,3R,4S)-3-[(E)-C-methyl-N-(phenylcarbamothioylamino)carbonimidoyl]-2-bicyclo[2.2.1]heptanyl]hept-5-enoic acid
Also Known As: EP 092, (Z)-7-[(1R,2R,3R,4S)-3-[(E)-C-Methyl-N-(phenylcarbamothioylamino)carbonimidoyl]-2-bicyclo[2.2.1]heptanyl]hept-5-enoic acid, 5-Heptenoic acid, 7-(3-(1-(((phenylamino)thioxomethyl)hydrazono)ethyl)bicyclo(2.2.1)hept-2-yl)-, (1alpha,2beta(Z),3alpha,4alpha)-(+-)-, (5Z)-7-[(1R,2R,3R,4S)-3-(1-{[(phenylcarbamothioyl)amino]imino}ethyl)bicyclo[2.2.1]heptan-2-yl]hept-5-enoic acid, (Z)-7-[(1alpha,4alpha)-3alpha-[1-[2-[(Phenylamino)thioxomethyl]hydrazono]ethyl]bicyclo[2.2.1]heptane-2beta-yl]-5-heptenoic acid
| Molecular Formula | C23H31N3O2S |
|---|---|
| Molecular Weight | 413.21 g/mol |
| LogP | 5.2124 |
| Topological Polar Surface Area | 73.72 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 413.21368 |
| Heavy Atoms | 29 |
| Complexity | 762.64624 |
Chemical Identifiers
| CAS Number | 96384-09-7 |
|---|---|
| SMILES | C/C(=N\NC(=S)NC1=CC=CC=C1)/[C@@H]2[C@H]3CC[C@H](C3)[C@H]2C/C=C\CCCC(=O)O |
Product Overview
EP 092 (CAS 96384-09-7), with molecular formula C23H31N3O2S and molecular weight 413.21 g/mol. IUPAC: (Z)-7-[(1R,2R,3R,4S)-3-[(E)-C-methyl-N-(phenylcarbamothioylamino)carbonimidoyl]-2-bicyclo[2.2.1]heptanyl]hept-5-enoic acid.
Chemical Property Profile of EP 092
Property Insights of EP 092
The XLogP value of 5.2124 indicates that EP 092 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.72 Ų falls within the moderate polarity range, balancing permeability and solubility for EP 092. Following Lipinski's Rule of Five, EP 092 has 3 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 EP 092?
The CAS number of EP 092 is 96384-09-7.
What is the molecular formula of EP 092?
The molecular formula of EP 092 is C23H31N3O2S.
What is the molecular weight of EP 092?
The molecular weight of EP 092 is 413.21 g/mol.
Where can I buy EP 092?
You can request a quote for EP 092 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EP 092?
Yes, KEHONG BIO provides custom synthesis services for EP 092 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.