![(E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline structure](/static/products/859/859665-40-0.png)
(E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline
TL;DR: (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline (CAS 859665-40-0) is a chemical compound with molecular formula C26H29Cl2N5O3 and molecular weight 529.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[1-[(E)-1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl]tetrazol-5-yl]-4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline
Also Known As: (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline, 5-[1-[(E)-1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl]tetrazol-5-yl]-4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline, 5-{1-[(1E)-1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl]-1H-tetrazol-5-yl}-4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinoline
| Molecular Formula | C26H29Cl2N5O3 |
|---|---|
| Molecular Weight | 529.16 g/mol |
| LogP | 5.5951 |
| Topological Polar Surface Area | 74.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 529.16473 |
| Heavy Atoms | 36 |
| Complexity | 1317.6389 |
Chemical Identifiers
| CAS Number | 859665-40-0 |
|---|---|
| SMILES | CC(C)(C)C(/C=C/C1=C(C=C(C=C1)Cl)Cl)N2C(=NN=N2)C3C4=C(C5=C(C=C4CCN3C)OCO5)OC |
Product Overview
(E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline (CAS 859665-40-0), with molecular formula C26H29Cl2N5O3 and molecular weight 529.16 g/mol. IUPAC: 5-[1-[(E)-1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl]tetrazol-5-yl]-4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline.
Chemical Property Profile of (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline
Property Insights of (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline
The XLogP value of 5.5951 indicates that (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.53 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline. Following Lipinski's Rule of Five, (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline?
The CAS number of (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline is 859665-40-0.
What is the molecular formula of (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline?
The molecular formula of (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline is C26H29Cl2N5O3.
What is the molecular weight of (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline?
The molecular weight of (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline is 529.16 g/mol.
Where can I buy (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline?
You can request a quote for (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-(1-(1-(2,4-dichlorophenyl)-4,4-dimethylpent-1-en-3-yl)-1H-tetrazol-5-yl)-4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.