十八烷二酸二甲酯
TL;DR: 十八烷二酸二甲酯 (CAS 1472-93-1) is a chemical compound with molecular formula C21H24N8O5 and molecular weight 468.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
十八烷二酸二甲酯
2-[[4-[(2,4-diaminopteridin-6-yl)methyl-ethylamino]benzoyl]amino]pentanedioic acid
Also Known As: Ethylaminopterin, N10-Ethylaminopterin, 10-Ethylaminopterin, n-(4-{[(2,4-diaminopteridin-6-yl)methyl](ethyl)amino}benzoyl)glutamic acid, 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-ethylamino]benzoyl]amino]pentanedioic acid
| Molecular Formula | C21H24N8O5 |
|---|---|
| Molecular Weight | 468.19 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 211.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 10 |
| Exact Mass | 468.18695 |
| Heavy Atoms | 34 |
| Complexity | 719.0 |
Chemical Identifiers
| CAS Number | 1472-93-1 |
|---|---|
| SMILES | CCN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O |
| InChIKey | POZRJDDKFDDOQR-UHFFFAOYSA-N |
Product Overview
十八烷二酸二甲酯 (CAS 1472-93-1), with molecular formula C21H24N8O5 and molecular weight 468.19 g/mol. IUPAC: 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-ethylamino]benzoyl]amino]pentanedioic acid.
Chemical Property Profile of 十八烷二酸二甲酯
Property Insights of 十八烷二酸二甲酯
The XLogP value of -1.5 indicates that 十八烷二酸二甲酯 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 211.0 Ų indicates high polarity, suggesting 十八烷二酸二甲酯 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 十八烷二酸二甲酯 has 5 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 十八烷二酸二甲酯?
The CAS number of 十八烷二酸二甲酯 is 1472-93-1.
What is the molecular formula of 十八烷二酸二甲酯?
The molecular formula of 十八烷二酸二甲酯 is C21H24N8O5.
What is the molecular weight of 十八烷二酸二甲酯?
The molecular weight of 十八烷二酸二甲酯 is 468.19 g/mol.
Where can I buy 十八烷二酸二甲酯?
You can request a quote for 十八烷二酸二甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 十八烷二酸二甲酯?
Yes, KEHONG BIO provides custom synthesis services for 十八烷二酸二甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.