RefChem:83617
TL;DR: RefChem:83617 (CAS 100063-61-4) is a chemical compound with molecular formula C23H28N4O7 and molecular weight 472.1958 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-[2-[[2-(2-hydroxyethylcarbamoyl)benzoyl]amino]ethyl-(hydroxymethyl)amino]ethylcarbamoyl]benzoic acid
Also Known As: 2-[2-[2-[[2-(2-hydroxyethylcarbamoyl)benzoyl]amino]ethyl-(hydroxymethyl)amino]ethylcarbamoyl]benzoic acid, 2-(((2-((2-((2-(((2-Hydroxyethyl)amino)carbonyl)benzoyl)amino)ethyl)(hydroxymethyl)amino)ethyl)amino)carbonyl)benzoic acid, 2-[[[2-[[2-[[2-[[(2-HYDROXYETHYL)AMINO]CARBONYL]BENZOYL]AMINO]ETHYL](HYDROXYMETHYL)AMINO]ETHYL]AMINO]CARBONYL]BENZOIC ACID, Benzoic acid, 2-[[[2-[[2-[[2-[[(2-hydroxyethyl)amino]carbonyl]benzoyl]amino]ethyl](hydroxymethyl)amino]ethyl]amino]carbonyl]-, 2-[[[2-[[2-[[2-[[(2-hydroxyethyl)amino]carbonyl]benzoyl]amino]ethyl](hydroxymethyl)amino]ethyl]amino
Technical Specifications
| Molecular Formula | C23H28N4O7 |
| Molecular Weight | 472.1958 g/mol |
| XLogP | -2.5 |
| Topological Polar Surface Area (TPSA) | 168.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 472.1958 Da |
| Heavy Atoms | 34 |
| Complexity | 690.0 |
| SMILES | C1=CC=C(C(=C1)C(=O)NCCN(CCNC(=O)C2=CC=CC=C2C(=O)O)CO)C(=O)NCCO |
| InChIKey | RAZAKZXSZQNECO-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:83617
Property Insights of RefChem:83617
The XLogP value of -2.5 indicates that RefChem:83617 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 168.0 Ų indicates high polarity, suggesting RefChem:83617 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:83617 has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:83617?
The CAS number of RefChem:83617 is 100063-61-4.
What is the molecular formula of RefChem:83617?
The molecular formula of RefChem:83617 is C23H28N4O7.
What is the molecular weight of RefChem:83617?
The molecular weight of RefChem:83617 is 472.1958 g/mol.
Where can I buy RefChem:83617?
You can request a quote for RefChem:83617 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:83617?
Yes, CoreyChem provides custom synthesis services for RefChem:83617 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.