ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate
TL;DR: ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate (CAS 155-15-7) is a chemical compound with molecular formula C27H27NO4 and molecular weight 429.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-benzhydrylidene-6,7-dimethoxy-3,4-dihydroisoquinoline-2-carboxylate
Also Known As: ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate, ethyl 1-benzhydrylidene-6,7-dimethoxy-3,4-dihydroisoquinolin, ethyl 1-benzhydrylidene-6,7-dimethoxy-3,4-dihydroisoquinoline-2-carboxylate, 2(1H)-Isoquinolinecarboxylicacid, 1-(diphenylmethylene)-3,4-dihydro-6,7-dimethoxy-, ethyl ester
| Molecular Formula | C27H27NO4 |
|---|---|
| Molecular Weight | 429.19 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.194 |
| Heavy Atoms | 32 |
| Complexity | 630.0 |
Chemical Identifiers
| CAS Number | 155-15-7 |
|---|---|
| SMILES | CCOC(=O)N1CCC2=CC(=C(C=C2C1=C(C3=CC=CC=C3)C4=CC=CC=C4)OC)OC |
| InChIKey | GTOVZUFZLOZCHK-UHFFFAOYSA-N |
Product Overview
ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate (CAS 155-15-7), with molecular formula C27H27NO4 and molecular weight 429.19 g/mol. IUPAC: ethyl 1-benzhydrylidene-6,7-dimethoxy-3,4-dihydroisoquinoline-2-carboxylate.
Chemical Property Profile of ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate
Property Insights of ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate
The XLogP value of 6.0 indicates that ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.0 Ų, ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate has 0 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 ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate?
The CAS number of ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate is 155-15-7.
What is the molecular formula of ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate?
The molecular formula of ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate is C27H27NO4.
What is the molecular weight of ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate?
The molecular weight of ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate is 429.19 g/mol.
Where can I buy ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate?
You can request a quote for ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 1-(diphenylmethylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1h)-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.