EiM07-29333
TL;DR: EiM07-29333 (CAS 957046-58-1) is a chemical compound with molecular formula C21H23NO6S and molecular weight 417.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[3-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanylbutanoic acid
Also Known As: EiM07-29333, (2S)-2-[3-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanylbutanoic acid, (S)-2-(3-(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)-4-(methylthio)butanoic acid
| Molecular Formula | C21H23NO6S |
|---|---|
| Molecular Weight | 417.12 g/mol |
| LogP | 3.41114 |
| Topological Polar Surface Area | 109.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 417.1246 |
| Heavy Atoms | 29 |
| Complexity | 1129.5894 |
Chemical Identifiers
| CAS Number | 957046-58-1 |
|---|---|
| SMILES | CC1=COC2=CC3=C(C=C12)C(=C(C(=O)O3)CCC(=O)N[C@@H](CCSC)C(=O)O)C |
Product Overview
EiM07-29333 (CAS 957046-58-1), with molecular formula C21H23NO6S and molecular weight 417.12 g/mol. IUPAC: (2S)-2-[3-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanylbutanoic acid.
Chemical Property Profile of EiM07-29333
Property Insights of EiM07-29333
The XLogP value of 3.41114 indicates that EiM07-29333 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.75 Ų falls within the moderate polarity range, balancing permeability and solubility for EiM07-29333. Following Lipinski's Rule of Five, EiM07-29333 has 2 hydrogen bond donor(s) and 6 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 EiM07-29333?
The CAS number of EiM07-29333 is 957046-58-1.
What is the molecular formula of EiM07-29333?
The molecular formula of EiM07-29333 is C21H23NO6S.
What is the molecular weight of EiM07-29333?
The molecular weight of EiM07-29333 is 417.12 g/mol.
Where can I buy EiM07-29333?
You can request a quote for EiM07-29333 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EiM07-29333?
Yes, KEHONG BIO provides custom synthesis services for EiM07-29333 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.