2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid
TL;DR: 2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid (CAS 1031807-13-2) is a chemical compound with molecular formula C17H27N3O4 and molecular weight 337.20016 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(6-aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid
Also Known As: VU0512758-1, 2-(6-aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid, F3177-0028, 2-((6-aminohexyl)amino)-4-((2-methoxyphenyl)amino)-4-oxobutanoic acid, 2-[(6-AMINOHEXYL)AMINO]-3-[(2-METHOXYPHENYL)CARBAMOYL]PROPANOIC ACID
Technical Specifications
| Molecular Formula | C17H27N3O4 |
| Molecular Weight | 337.20016 g/mol |
| XLogP | -1.0 |
| Topological Polar Surface Area (TPSA) | 114.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 337.20016 Da |
| Heavy Atoms | 24 |
| Complexity | 379.0 |
| SMILES | COC1=CC=CC=C1NC(=O)CC(C(=O)O)NCCCCCCN |
| InChIKey | HUIWRJWQLCYZLI-UHFFFAOYSA-N |
Chemical Property Profile of 2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid
Property Insights of 2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid
The XLogP value of -1.0 indicates that 2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid. Following Lipinski's Rule of Five, 2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid?
The CAS number of 2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid is 1031807-13-2.
What is the molecular formula of 2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid?
The molecular formula of 2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid is C17H27N3O4.
What is the molecular weight of 2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid?
The molecular weight of 2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid is 337.20016 g/mol.
Where can I buy 2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid?
You can request a quote for 2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid?
Yes, CoreyChem provides custom synthesis services for 2-(6-Aminohexylamino)-4-(2-methoxyanilino)-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.