RS 93007
TL;DR: RS 93007 (CAS 105740-30-5) is a chemical compound with molecular formula C28H39ClN2O4 and molecular weight 502.25983 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-3-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile;hydrochloride
Also Known As: ethyl 3-butynyl sulfide, RS 93007, 3-Isoquinolinepentanenitrile, alpha-(3,4-dimethoxyphenyl)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-alpha-(1-methylethyl)-, monohydrochloride, 5-(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-3-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile;hydrochloride, 3-(4-Cyano-4-(3,4-dimethoxyphenyl)-5-methylhex-1-yl)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methylisoquinoline
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C28H39ClN2O4 |
| Molecular Weight | 502.25983 g/mol |
| XLogP | 5.78718 |
| Topological Polar Surface Area (TPSA) | 64.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 502.25983 Da |
| Heavy Atoms | 35 |
| Complexity | 679.0 |
| SMILES | CC(C)C(CCCC1CC2=CC(=C(C=C2CN1C)OC)OC)(C#N)C3=CC(=C(C=C3)OC)OC.Cl |
| InChIKey | VUZBKYKCWFNKMU-UHFFFAOYSA-N |
Chemical Property Profile of RS 93007
Property Insights of RS 93007
The XLogP value of 5.78718 indicates that RS 93007 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RS 93007. Following Lipinski's Rule of Five, RS 93007 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RS 93007?
The CAS number of RS 93007 is 105740-30-5.
What is the molecular formula of RS 93007?
The molecular formula of RS 93007 is C28H39ClN2O4.
What is the molecular weight of RS 93007?
The molecular weight of RS 93007 is 502.25983 g/mol.
Where can I buy RS 93007?
You can request a quote for RS 93007 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RS 93007?
Yes, CoreyChem provides custom synthesis services for RS 93007 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.