(1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline
TL;DR: (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline (CAS 1391440-71-3) is a chemical compound with molecular formula C15H19N and molecular weight 213.15175 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,3S)-1,3-bis(prop-2-enyl)-1,2,3,4-tetrahydroisoquinoline
Also Known As: (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline, BAS 02800960, J1.492.842A, AB01319922-02, trans-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline
Technical Specifications
| Molecular Formula | C15H19N |
| Molecular Weight | 213.15175 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 213.15175 Da |
| Heavy Atoms | 16 |
| Complexity | 246.0 |
| SMILES | C=CC[C@H]1CC2=CC=CC=C2[C@@H](N1)CC=C |
| InChIKey | LKIGZPJQDYMQKT-ZFWWWQNUSA-N |
Chemical Property Profile of (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline
Property Insights of (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline
The XLogP value of 3.6 indicates that (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline?
The CAS number of (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline is 1391440-71-3.
What is the molecular formula of (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline?
The molecular formula of (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline is C15H19N.
What is the molecular weight of (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline?
The molecular weight of (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline is 213.15175 g/mol.
Where can I buy (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline?
You can request a quote for (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline?
Yes, CoreyChem provides custom synthesis services for (1S,3S)-1,3-diallyl-1,2,3,4-tetrahydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.