Fawcettidine
TL;DR: Fawcettidine (CAS 14912-31-3) is a chemical compound with molecular formula C16H23NO and molecular weight 245.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,4R,6S,9S)-4-methyl-13-azatetracyclo[7.7.0.01,6.02,13]hexadec-2-en-8-one
Also Known As: Fawcettidine, (+)-Fawcettidine, ( )-Fawcettidine, (6S)-3,6-dimethyl-6,7-dihydro-5H-benzofuran-4-one, (1S,4R,6S,9S)-4-methyl-13-azatetracyclo[7.7.0.01,6.02,13]hexadec-2-en-8-one
| Molecular Formula | C16H23NO |
|---|---|
| Molecular Weight | 245.18 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 245.17796 |
| Heavy Atoms | 18 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 14912-31-3 |
|---|---|
| SMILES | C[C@@H]1C[C@H]2CC(=O)[C@@H]3[C@]24CCCN(C4=C1)CCC3 |
| InChIKey | ANHVSCXCALAIQN-IATRGZMQSA-N |
Product Overview
Fawcettidine (CAS 14912-31-3), with molecular formula C16H23NO and molecular weight 245.18 g/mol. IUPAC: (1S,4R,6S,9S)-4-methyl-13-azatetracyclo[7.7.0.01,6.02,13]hexadec-2-en-8-one.
Chemical Property Profile of Fawcettidine
Property Insights of Fawcettidine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Fawcettidine. With a topological polar surface area (TPSA) of 20.3 Ų, Fawcettidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Fawcettidine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Fawcettidine?
The CAS number of Fawcettidine is 14912-31-3.
What is the molecular formula of Fawcettidine?
The molecular formula of Fawcettidine is C16H23NO.
What is the molecular weight of Fawcettidine?
The molecular weight of Fawcettidine is 245.18 g/mol.
Where can I buy Fawcettidine?
You can request a quote for Fawcettidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fawcettidine?
Yes, KEHONG BIO provides custom synthesis services for Fawcettidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.