![2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid structure](/static/products/1031/1031807-52-9.webp)
2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid
TL;DR: 2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid (CAS 1031807-52-9) is a chemical compound with molecular formula C20H25N3O4 and molecular weight 371.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid
Also Known As: VU0512766-1, F3177-0037, 2-{[2-(BENZYLAMINO)ETHYL]AMINO}-3-[(2-METHOXYPHENYL)CARBAMOYL]PROPANOIC ACID, 2-[2-(benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid, 2-((2-(benzylamino)ethyl)amino)-4-((2-methoxyphenyl)amino)-4-oxobutanoic acid
| Molecular Formula | C20H25N3O4 |
|---|---|
| Molecular Weight | 371.18 g/mol |
| LogP | 1.8564 |
| Topological Polar Surface Area | 99.69 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 371.1845 |
| Heavy Atoms | 27 |
| Complexity | 737.0165 |
Chemical Identifiers
| CAS Number | 1031807-52-9 |
|---|---|
| SMILES | COC1=CC=CC=C1NC(=O)CC(C(=O)O)NCCNCC2=CC=CC=C2 |
Product Overview
2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid (CAS 1031807-52-9), with molecular formula C20H25N3O4 and molecular weight 371.18 g/mol. IUPAC: 2-[2-(benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid.
Chemical Property Profile of 2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid
Property Insights of 2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid
The XLogP value of 1.8564 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid. The TPSA of 99.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid. Following Lipinski's Rule of Five, 2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid?
The CAS number of 2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid is 1031807-52-9.
What is the molecular formula of 2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid?
The molecular formula of 2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid is C20H25N3O4.
What is the molecular weight of 2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid?
The molecular weight of 2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid is 371.18 g/mol.
Where can I buy 2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid?
You can request a quote for 2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(Benzylamino)ethylamino]-4-(2-methoxyanilino)-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.