EINECS 303-801-6
TL;DR: EINECS 303-801-6 (CAS 94230-89-4) is a chemical compound with molecular formula C22H29NO2 and molecular weight 339.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone
Also Known As: EINECS 303-801-6, 2-(CYCLOBUTYLCARBONYL)-1,2,3,4,5,6,7,8-OCTAHYDRO-1-[(4-METHOXYPHENYL)METHYL]ISOQUINOLINE, 2-(Cyclobutylcarbonyl)-1,2,3,4,5,6,7,8-octahydro-1-((4-methoxyphenyl)methyl)isoquinoline, cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone, 2-cyclobutanecarbonyl-1-[(4-methoxyphenyl)methyl]-1,2,3,4,5,6,7,8-octahydroisoquinoline
| Molecular Formula | C22H29NO2 |
|---|---|
| Molecular Weight | 339.22 g/mol |
| LogP | 4.5093 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.21982 |
| Heavy Atoms | 25 |
| Complexity | 657.10974 |
Chemical Identifiers
| CAS Number | 94230-89-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CC2C3=C(CCCC3)CCN2C(=O)C4CCC4 |
Product Overview
EINECS 303-801-6 (CAS 94230-89-4), with molecular formula C22H29NO2 and molecular weight 339.22 g/mol. IUPAC: cyclobutyl-[1-[(4-methoxyphenyl)methyl]-3,4,5,6,7,8-hexahydro-1H-isoquinolin-2-yl]methanone.
Chemical Property Profile of EINECS 303-801-6
Property Insights of EINECS 303-801-6
The XLogP value of 4.5093 indicates that EINECS 303-801-6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, EINECS 303-801-6 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, EINECS 303-801-6 has 0 hydrogen bond donor(s) and 2 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 303-801-6?
The CAS number of EINECS 303-801-6 is 94230-89-4.
What is the molecular formula of EINECS 303-801-6?
The molecular formula of EINECS 303-801-6 is C22H29NO2.
What is the molecular weight of EINECS 303-801-6?
The molecular weight of EINECS 303-801-6 is 339.22 g/mol.
Where can I buy EINECS 303-801-6?
You can request a quote for EINECS 303-801-6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 303-801-6?
Yes, KEHONG BIO provides custom synthesis services for EINECS 303-801-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.