RefChem:349939
TL;DR: RefChem:349939 (CAS 84218-41-7) is a chemical compound with molecular formula C28H31N3O2 and molecular weight 441.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[1-(1H-indol-3-ylmethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-2-methylaniline
Also Known As: 2,5-diphenyl-1,4-distyrylbenzene, 6,7-Dimethoxy-1-(3-indolylmethyl)-2-((o-toluidino)methyl)-1,2,3,4-tetrahydroisoquinoline, Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-1-(3-indolylmethyl)-2-((o-toluidino)methyl)-, N-[[1-(1H-indol-3-ylmethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-2-methylaniline, ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-1-(3-INDOLYLMETHYL)-2-((o-TOLUIDI
| Molecular Formula | C28H31N3O2 |
|---|---|
| Molecular Weight | 441.24 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 49.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 441.24164 |
| Heavy Atoms | 33 |
| Complexity | 618.0 |
Chemical Identifiers
| CAS Number | 84218-41-7 |
|---|---|
| SMILES | CC1=CC=CC=C1NCN2CCC3=CC(=C(C=C3C2CC4=CNC5=CC=CC=C54)OC)OC |
| InChIKey | GSTJTDPFWIZFCB-UHFFFAOYSA-N |
Product Overview
RefChem:349939 (CAS 84218-41-7), with molecular formula C28H31N3O2 and molecular weight 441.24 g/mol. IUPAC: N-[[1-(1H-indol-3-ylmethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-2-methylaniline.
Chemical Property Profile of RefChem:349939
Property Insights of RefChem:349939
The XLogP value of 6.0 indicates that RefChem:349939 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.5 Ų, RefChem:349939 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:349939 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:349939?
The CAS number of RefChem:349939 is 84218-41-7.
What is the molecular formula of RefChem:349939?
The molecular formula of RefChem:349939 is C28H31N3O2.
What is the molecular weight of RefChem:349939?
The molecular weight of RefChem:349939 is 441.24 g/mol.
Where can I buy RefChem:349939?
You can request a quote for RefChem:349939 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:349939?
Yes, KEHONG BIO provides custom synthesis services for RefChem:349939 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.