RefChem:349940
TL;DR: RefChem:349940 (CAS 84270-31-5) is a chemical compound with molecular formula C28H31N3O2 and molecular weight 441.24164 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[[1-(1H-indol-3-ylmethyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-4-methylaniline
Also Known As: 6,7-Dimethoxy-1-(3-indolylmethyl)-2-((p-toluidino)methyl)-1,2,3,4-tetrahydroisoquinoline, Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-1-(3-indolylmethyl)-2-((p-toluidino)methyl)-, ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-1-(3-INDOLYLMETHYL)-2-((p-TOLUIDI, 1,2,3,4-Tetrahydro-6,7-dimethoxy-1-[(1H-indol-3-yl)methyl]-2-[(p-toluidino)methyl]isoquinoline, N-({1-[(1H-indol-3-yl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-yl}methyl)-4-methylaniline
Technical Specifications
| Molecular Formula | C28H31N3O2 |
| Molecular Weight | 441.24164 g/mol |
| XLogP | 6.0 |
| Topological Polar Surface Area (TPSA) | 49.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 441.24164 Da |
| Heavy Atoms | 33 |
| Complexity | 610.0 |
| SMILES | CC1=CC=C(C=C1)NCN2CCC3=CC(=C(C=C3C2CC4=CNC5=CC=CC=C54)OC)OC |
| InChIKey | YLPFJTKMEWVEEX-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:349940
Property Insights of RefChem:349940
The XLogP value of 6.0 indicates that RefChem:349940 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:349940 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:349940 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:349940?
The CAS number of RefChem:349940 is 84270-31-5.
What is the molecular formula of RefChem:349940?
The molecular formula of RefChem:349940 is C28H31N3O2.
What is the molecular weight of RefChem:349940?
The molecular weight of RefChem:349940 is 441.24164 g/mol.
Where can I buy RefChem:349940?
You can request a quote for RefChem:349940 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:349940?
Yes, CoreyChem provides custom synthesis services for RefChem:349940 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.