Anatoxin a(S)
TL;DR: Anatoxin a(S) (CAS 103170-78-1) is a chemical compound with molecular formula C7H17N4O4P and molecular weight 252.09874 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(5S)-2-amino-5-[(dimethylamino)methyl]-4,5-dihydroimidazol-1-yl] methyl hydrogen phosphate
Also Known As: Anatoxin a(s), Anatoxin-A(S), Guanitoxin, Antx-a(s, Anatoxin-AS
Technical Specifications
| Molecular Formula | C7H17N4O4P |
| Molecular Weight | 252.09874 g/mol |
| XLogP | -4.4 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 252.09874 Da |
| Heavy Atoms | 16 |
| Complexity | 322.0 |
| SMILES | CN(C)C[C@H]1CN=C(N1OP(=O)(O)OC)N |
| InChIKey | FYXHGVMFJYHPFX-ZCFIWIBFSA-N |
Chemical Property Profile of Anatoxin a(S)
Property Insights of Anatoxin a(S)
The XLogP value of -4.4 indicates that Anatoxin a(S) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Anatoxin a(S). Following Lipinski's Rule of Five, Anatoxin a(S) has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Anatoxin a(S)?
The CAS number of Anatoxin a(S) is 103170-78-1.
What is the molecular formula of Anatoxin a(S)?
The molecular formula of Anatoxin a(S) is C7H17N4O4P.
What is the molecular weight of Anatoxin a(S)?
The molecular weight of Anatoxin a(S) is 252.09874 g/mol.
Where can I buy Anatoxin a(S)?
You can request a quote for Anatoxin a(S) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Anatoxin a(S)?
Yes, CoreyChem provides custom synthesis services for Anatoxin a(S) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.