EiM08-28846
TL;DR: EiM08-28846 (CAS 771505-16-9) is a chemical compound with molecular formula C22H24N2O3S and molecular weight 396.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-benzothiazol-2-yl)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butan-1-one
Also Known As: EiM08-28846, 4-(1,3-benzothiazol-2-yl)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)butan-1-one, 4-(1,3-benzothiazol-2-yl)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butan-1-one, 4-(benzo[d]thiazol-2-yl)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)butan-1-one, 4-(1,3-benzothiazol-2-yl)-1-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-yl)butan-1-one
| Molecular Formula | C22H24N2O3S |
|---|---|
| Molecular Weight | 396.15 g/mol |
| LogP | 4.2211 |
| Topological Polar Surface Area | 51.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 396.15076 |
| Heavy Atoms | 28 |
| Complexity | 965.6106 |
Chemical Identifiers
| CAS Number | 771505-16-9 |
|---|---|
| SMILES | COC1=C(C=C2CN(CCC2=C1)C(=O)CCCC3=NC4=CC=CC=C4S3)OC |
Product Overview
EiM08-28846 (CAS 771505-16-9), with molecular formula C22H24N2O3S and molecular weight 396.15 g/mol. IUPAC: 4-(1,3-benzothiazol-2-yl)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butan-1-one.
Chemical Property Profile of EiM08-28846
Property Insights of EiM08-28846
The XLogP value of 4.2211 indicates that EiM08-28846 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.66 Ų, EiM08-28846 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, EiM08-28846 has 0 hydrogen bond donor(s) and 5 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 EiM08-28846?
The CAS number of EiM08-28846 is 771505-16-9.
What is the molecular formula of EiM08-28846?
The molecular formula of EiM08-28846 is C22H24N2O3S.
What is the molecular weight of EiM08-28846?
The molecular weight of EiM08-28846 is 396.15 g/mol.
Where can I buy EiM08-28846?
You can request a quote for EiM08-28846 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EiM08-28846?
Yes, KEHONG BIO provides custom synthesis services for EiM08-28846 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.