EINECS 266-291-3
TL;DR: EINECS 266-291-3 (CAS 66264-96-8) is a chemical compound with molecular formula C20H28ClNO3S and molecular weight 397.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[1-hydroxy-2-[4-(4-methoxyphenyl)butan-2-ylamino]ethyl]-2-methylsulfanylphenol;hydrochloride
Also Known As: EINECS 266-291-3, 4-Hydroxy-alpha-(((3-(4-methoxyphenyl)-1-methylpropyl)amino)methyl)-3-(methylthio)benzyl alcohol hydrochloride, 4-[1-hydroxy-2-[4-(4-methoxyphenyl)butan-2-ylamino]ethyl]-2-methylsulfanylphenol hydrochloride, 4-hydroxy-alpha-[[[3- -1-methylpropyl]amino]methyl]-3- benzylalcoholhydrochloride, 4-(1-Hydroxy-2-{[4-(4-methoxyphenyl)butan-2-yl]amino}ethyl)-2-(methylsulfanyl)phenol--hydrogen chloride (1/1)
| Molecular Formula | C20H28ClNO3S |
|---|---|
| Molecular Weight | 397.15 g/mol |
| LogP | 4.1888 |
| Topological Polar Surface Area | 61.72 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 397.14786 |
| Heavy Atoms | 26 |
| Complexity | 666.6059 |
Chemical Identifiers
| CAS Number | 66264-96-8 |
|---|---|
| SMILES | CC(CCC1=CC=C(C=C1)OC)NCC(C2=CC(=C(C=C2)O)SC)O.Cl |
Product Overview
EINECS 266-291-3 (CAS 66264-96-8), with molecular formula C20H28ClNO3S and molecular weight 397.15 g/mol. IUPAC: 4-[1-hydroxy-2-[4-(4-methoxyphenyl)butan-2-ylamino]ethyl]-2-methylsulfanylphenol;hydrochloride.
Chemical Property Profile of EINECS 266-291-3
Property Insights of EINECS 266-291-3
The XLogP value of 4.1888 indicates that EINECS 266-291-3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.72 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 266-291-3. Following Lipinski's Rule of Five, EINECS 266-291-3 has 3 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 EINECS 266-291-3?
The CAS number of EINECS 266-291-3 is 66264-96-8.
What is the molecular formula of EINECS 266-291-3?
The molecular formula of EINECS 266-291-3 is C20H28ClNO3S.
What is the molecular weight of EINECS 266-291-3?
The molecular weight of EINECS 266-291-3 is 397.15 g/mol.
Where can I buy EINECS 266-291-3?
You can request a quote for EINECS 266-291-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 266-291-3?
Yes, KEHONG BIO provides custom synthesis services for EINECS 266-291-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.