2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid
TL;DR: 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid (CAS 2352-88-7) is a chemical compound with molecular formula C48H85N3O5 and molecular weight 783.65 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis[2-(octadecanoylamino)ethyl]carbamoyl]benzoic acid
Also Known As: 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid, 2-[bis[2-(octadecanoylamino)ethyl]carbamoyl]benzoic acid, 2-{bis[2-(stearoylamino)ethyl]carbamoyl}benzoic acid, 2-[BIS(2-OCTADECANAMIDOETHYL)CARBAMOYL]BENZOIC ACID, 2-[[BIS[2-[(1-OXOOCTADECYL)AMINO]ETHYL]AMINO]CARBONYL]BENZOIC ACID
| Molecular Formula | C48H85N3O5 |
|---|---|
| Molecular Weight | 783.65 g/mol |
| LogP | 16.4 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 40 |
| Exact Mass | 783.6489 |
| Heavy Atoms | 56 |
| Complexity | 907.0 |
Chemical Identifiers
| CAS Number | 2352-88-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)NCCN(CCNC(=O)CCCCCCCCCCCCCCCCC)C(=O)C1=CC=CC=C1C(=O)O |
| InChIKey | CJMFXGGZYSIPRT-UHFFFAOYSA-N |
Product Overview
2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid (CAS 2352-88-7), with molecular formula C48H85N3O5 and molecular weight 783.65 g/mol. IUPAC: 2-[bis[2-(octadecanoylamino)ethyl]carbamoyl]benzoic acid.
Chemical Property Profile of 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid
Property Insights of 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid
The XLogP value of 16.4 indicates that 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid. Following Lipinski's Rule of Five, 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid?
The CAS number of 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid is 2352-88-7.
What is the molecular formula of 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid?
The molecular formula of 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid is C48H85N3O5.
What is the molecular weight of 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid?
The molecular weight of 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid is 783.65 g/mol.
Where can I buy 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid?
You can request a quote for 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-((Bis(2-((1-oxooctadecyl)amino)ethyl)amino)carbonyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.