2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid
TL;DR: 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid (CAS 64801-59-8) is a chemical compound with molecular formula C25H33N9O4 and molecular weight 523.27 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-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid
Also Known As: 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid, L-Glutamine,4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-N-pentyl-, N~2~-(4-{[(2,4-Diaminopteridin-6-yl)methyl](methyl)amino}benzoyl)-N-pentylglutamine, 2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-4-pentylcarbamoyl-butyric acid
| Molecular Formula | C25H33N9O4 |
|---|---|
| Molecular Weight | 523.27 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 202.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 13 |
| Exact Mass | 523.26556 |
| Heavy Atoms | 38 |
| Complexity | 780.0 |
Chemical Identifiers
| CAS Number | 64801-59-8 |
|---|---|
| SMILES | CCCCCNC(=O)CCC(C(=O)O)NC(=O)C1=CC=C(C=C1)N(C)CC2=CN=C3C(=N2)C(=NC(=N3)N)N |
| InChIKey | IOUZGHRFZVBUGI-UHFFFAOYSA-N |
Product Overview
2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid (CAS 64801-59-8), with molecular formula C25H33N9O4 and molecular weight 523.27 g/mol. IUPAC: 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid.
Chemical Property Profile of 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid
Property Insights of 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid
The XLogP value of -0.3 indicates that 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 202.0 Ų indicates high polarity, suggesting 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid?
The CAS number of 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid is 64801-59-8.
What is the molecular formula of 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid?
The molecular formula of 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid is C25H33N9O4.
What is the molecular weight of 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid?
The molecular weight of 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid is 523.27 g/mol.
Where can I buy 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid?
You can request a quote for 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxo-5-(pentylamino)pentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.