Desethylhycanthone
TL;DR: Desethylhycanthone (CAS 13479-19-1) is a chemical compound with molecular formula C18H20N2O2S and molecular weight 328.12454 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-(ethylamino)ethylamino]-4-(hydroxymethyl)thioxanthen-9-one
Also Known As: Desethylhycanthone, Deethyl hycanthone, Deethylhycanthone, HYCANTHONE_met032, WIN 27,262
Technical Specifications
| Molecular Formula | C18H20N2O2S |
| Molecular Weight | 328.12454 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 86.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 328.12454 Da |
| Heavy Atoms | 23 |
| Complexity | 406.0 |
| SMILES | CCNCCNC1=C2C(=C(C=C1)CO)SC3=CC=CC=C3C2=O |
| InChIKey | LHFGEJHYNJLFOV-UHFFFAOYSA-N |
Chemical Property Profile of Desethylhycanthone
Property Insights of Desethylhycanthone
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Desethylhycanthone. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Desethylhycanthone. Following Lipinski's Rule of Five, Desethylhycanthone has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Desethylhycanthone?
The CAS number of Desethylhycanthone is 13479-19-1.
What is the molecular formula of Desethylhycanthone?
The molecular formula of Desethylhycanthone is C18H20N2O2S.
What is the molecular weight of Desethylhycanthone?
The molecular weight of Desethylhycanthone is 328.12454 g/mol.
Where can I buy Desethylhycanthone?
You can request a quote for Desethylhycanthone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Desethylhycanthone?
Yes, CoreyChem provides custom synthesis services for Desethylhycanthone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.