5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid
TL;DR: 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid (CAS 71074-46-9) is a chemical compound with molecular formula C22H25N9O6 and molecular weight 511.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid
Also Known As: 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid, Glycine,4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-L-.gamma.-glutamyl]-, N-(4-{[(2,4-Diaminopteridin-6-yl)methyl](methyl)amino}benzoyl)-gamma-glutamylglycine, 4-(Carboxymethyl-carbamoyl)-2-{4-[(2,4-diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-butyric acid
| Molecular Formula | C22H25N9O6 |
|---|---|
| Molecular Weight | 511.19 g/mol |
| LogP | -2.5 |
| Topological Polar Surface Area | 240.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 11 |
| Exact Mass | 511.19278 |
| Heavy Atoms | 37 |
| Complexity | 824.0 |
Chemical Identifiers
| CAS Number | 71074-46-9 |
|---|---|
| SMILES | CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NC(CCC(=O)NCC(=O)O)C(=O)O |
| InChIKey | UCADQUQKRCWKNP-UHFFFAOYSA-N |
Product Overview
5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid (CAS 71074-46-9), with molecular formula C22H25N9O6 and molecular weight 511.19 g/mol. IUPAC: 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid.
Chemical Property Profile of 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid
Property Insights of 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid
The XLogP value of -2.5 indicates that 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 240.0 Ų indicates high polarity, suggesting 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid has 6 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid?
The CAS number of 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid is 71074-46-9.
What is the molecular formula of 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid?
The molecular formula of 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid is C22H25N9O6.
What is the molecular weight of 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid?
The molecular weight of 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid is 511.19 g/mol.
Where can I buy 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid?
You can request a quote for 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(carboxymethylamino)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.