Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium)
TL;DR: Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium) (CAS 7413-34-5) is a chemical compound with molecular formula C20H20N8Na2O5 and molecular weight 498.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioate
Also Known As: Ledertrexate, Abitrexate, Amethopterin, Farmitrexat, Sodium methotrexate
| Molecular Formula | C20H20N8Na2O5 |
|---|---|
| Molecular Weight | 498.14 g/mol |
| LogP | -8.39 |
| Topological Polar Surface Area | 216.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 7 |
| Exact Mass | 498.1352 |
| Heavy Atoms | 35 |
| Complexity | 693.0 |
Chemical Identifiers
| CAS Number | 7413-34-5 |
|---|---|
| SMILES | CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NC(CCC(=O)[O-])C(=O)[O-].[Na+].[Na+] |
| InChIKey | DASQOOZCTWOQPA-UHFFFAOYSA-L |
Product Overview
Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium) (CAS 7413-34-5), with molecular formula C20H20N8Na2O5 and molecular weight 498.14 g/mol. IUPAC: disodium;2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioate.
Chemical Property Profile of Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium)
Property Insights of Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium)
The XLogP value of -8.39 indicates that Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 216.0 Ų indicates high polarity, suggesting Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium) has 3 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium)?
The CAS number of Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium) is 7413-34-5.
What is the molecular formula of Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium)?
The molecular formula of Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium) is C20H20N8Na2O5.
What is the molecular weight of Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium)?
The molecular weight of Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium) is 498.14 g/mol.
Where can I buy Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium)?
You can request a quote for Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium)?
Yes, KEHONG BIO provides custom synthesis services for Amethopterin (disodium);CL14377 (disodium);WR19039 (disodium) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.