amino}benzoyl)glutamic acid structure](/static/products/7053/70539-62-7.webp)
N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid
TL;DR: N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid (CAS 70539-62-7) is a chemical compound with molecular formula C27H28N8O5 and molecular weight 544.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-[(2,4-diaminopteridin-6-yl)methyl-(2-phenylethyl)amino]benzoyl]amino]pentanedioic acid
Also Known As: N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid, 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-phenethylamino]benzoyl]amino]pentanedioic acid
| Molecular Formula | C27H28N8O5 |
|---|---|
| Molecular Weight | 544.22 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 211.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 12 |
| Exact Mass | 544.21826 |
| Heavy Atoms | 40 |
| Complexity | 851.0 |
Chemical Identifiers
| CAS Number | 70539-62-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCN(CC2=CN=C3C(=N2)C(=NC(=N3)N)N)C4=CC=C(C=C4)C(=O)NC(CCC(=O)O)C(=O)O |
| InChIKey | HEDOSKNOYVOYRZ-UHFFFAOYSA-N |
Product Overview
N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid (CAS 70539-62-7), with molecular formula C27H28N8O5 and molecular weight 544.22 g/mol. IUPAC: 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-(2-phenylethyl)amino]benzoyl]amino]pentanedioic acid.
Chemical Property Profile of N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid
Property Insights of N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid. The TPSA of 211.0 Ų indicates high polarity, suggesting N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid 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 N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid?
The CAS number of N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid is 70539-62-7.
What is the molecular formula of N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid?
The molecular formula of N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid is C27H28N8O5.
What is the molecular weight of N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid?
The molecular weight of N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid is 544.22 g/mol.
Where can I buy N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid?
You can request a quote for N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](2-phenylethyl)amino}benzoyl)glutamic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.