Lek 8804
TL;DR: Lek 8804 (CAS 153415-44-2) is a chemical compound with molecular formula C20H21N3O and molecular weight 319.16846 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6aR,9R)-N,7-dimethyl-N-prop-2-ynyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
Also Known As: Lek 8804, 9,10-Didehydro-N-(2-propynyl)-6-methylergoline-8-carboxamide, (6aR,9R)-N,7-dimethyl-N-prop-2-ynyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide, Ergoline-8-carboxamide, 9,10-didehydro-6-methyl-N-(2-propynyl)-, (8beta)-, (6aR,9R)-7-methyl-N-prop-2-ynyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
Technical Specifications
| Molecular Formula | C20H21N3O |
| Molecular Weight | 319.16846 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 39.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 319.16846 Da |
| Heavy Atoms | 24 |
| Complexity | 603.0 |
| SMILES | CN1C[C@@H](C=C2[C@H]1CC3=CNC4=CC=CC2=C34)C(=O)N(C)CC#C |
| InChIKey | NTIBYWGZNANJNM-RDTXWAMCSA-N |
Chemical Property Profile of Lek 8804
Property Insights of Lek 8804
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Lek 8804. With a topological polar surface area (TPSA) of 39.3 Ų, Lek 8804 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Lek 8804 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Lek 8804?
The CAS number of Lek 8804 is 153415-44-2.
What is the molecular formula of Lek 8804?
The molecular formula of Lek 8804 is C20H21N3O.
What is the molecular weight of Lek 8804?
The molecular weight of Lek 8804 is 319.16846 g/mol.
Where can I buy Lek 8804?
You can request a quote for Lek 8804 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Lek 8804?
Yes, CoreyChem provides custom synthesis services for Lek 8804 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.