EINECS 262-683-3
TL;DR: EINECS 262-683-3 (CAS 94107-36-5) is a chemical compound with molecular formula C24H29NO5 and molecular weight 411.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-6-[(4-methoxyphenyl)methyl]-4,5-dimethyl-3,6-dihydro-2H-pyridine;oxalic acid
Also Known As: EINECS 262-683-3, 1-Benzyl-1,2,5,6-tetrahydro-2-((4-methoxyphenyl)methyl)-3,4-dimethylpyridinium hydrogen oxalate, 1-BENZYL-1,2,5,6-TETRAHYDRO-2-[(4-METHOXYPHENYL)METHYL]-3,4-DIMETHYLPYRIDINIUM HYDROGEN OXALATE, 1-benzyl-6-[(4-methoxyphenyl)methyl]-4,5-dimethyl-3,6-dihydro-2H-pyridine; oxalic acid, 1,2,5,6-Tetrahydro-2-[(4-methoxyphenyl)methyl]-3,4-dimethyl-1-(phenylmethyl)pyridine ethanedioate
| Molecular Formula | C24H29NO5 |
|---|---|
| Molecular Weight | 411.20 g/mol |
| LogP | 4.0042 |
| Topological Polar Surface Area | 87.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.20456 |
| Heavy Atoms | 30 |
| Complexity | 862.2291 |
Chemical Identifiers
| CAS Number | 94107-36-5 |
|---|---|
| SMILES | CC1=C(C(N(CC1)CC2=CC=CC=C2)CC3=CC=C(C=C3)OC)C.C(=O)(C(=O)O)O |
Product Overview
EINECS 262-683-3 (CAS 94107-36-5), with molecular formula C24H29NO5 and molecular weight 411.20 g/mol. IUPAC: 1-benzyl-6-[(4-methoxyphenyl)methyl]-4,5-dimethyl-3,6-dihydro-2H-pyridine;oxalic acid.
Chemical Property Profile of EINECS 262-683-3
Property Insights of EINECS 262-683-3
The XLogP value of 4.0042 indicates that EINECS 262-683-3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.07 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 262-683-3. Following Lipinski's Rule of Five, EINECS 262-683-3 has 2 hydrogen bond donor(s) and 4 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 262-683-3?
The CAS number of EINECS 262-683-3 is 94107-36-5.
What is the molecular formula of EINECS 262-683-3?
The molecular formula of EINECS 262-683-3 is C24H29NO5.
What is the molecular weight of EINECS 262-683-3?
The molecular weight of EINECS 262-683-3 is 411.20 g/mol.
Where can I buy EINECS 262-683-3?
You can request a quote for EINECS 262-683-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 262-683-3?
Yes, KEHONG BIO provides custom synthesis services for EINECS 262-683-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.