Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate
TL;DR: Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate (CAS 63980-74-5) is a chemical compound with molecular formula C22H26N6O9 and molecular weight 518.17615 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(diethylamino)-N-(2,3-dihydro-1H-inden-1-ylcarbamoyl)acetamide;2,4,6-trinitrophenol
Also Known As: 1-(2-Diethylaminoacetyl)-3-(1-indanyl)urea picrate, Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate, n-(2,3-dihydro-1h-inden-1-ylcarbamoyl)-n2,n2-diethylglycinamide- 2,4,6-trinitrophenol(1:1), 2-(diethylamino)-N-(2,3-dihydro-1H-inden-1-ylcarbamoyl)acetamide; 2,4,6-trinitrophenol, (Diethylamino)-N-{[(2,3-dihydro-1H-inden-1-yl)imino](hydroxy)methyl}ethanimidic acid--2,4,6-trinitrophenol (1/1)
Technical Specifications
| Molecular Formula | C22H26N6O9 |
| Molecular Weight | 518.17615 g/mol |
| XLogP | 2.96 |
| Topological Polar Surface Area (TPSA) | 219.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 518.17615 Da |
| Heavy Atoms | 37 |
| Complexity | 660.0 |
| SMILES | CCN(CC)CC(=O)NC(=O)NC1CCC2=CC=CC=C12.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | DMHGIHPCOOHUNP-UHFFFAOYSA-N |
Chemical Property Profile of Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate
Property Insights of Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate
The XLogP value of 2.96 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate. The TPSA of 219.0 Ų indicates high polarity, suggesting Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate?
The CAS number of Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate is 63980-74-5.
What is the molecular formula of Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate?
The molecular formula of Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate is C22H26N6O9.
What is the molecular weight of Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate?
The molecular weight of Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate is 518.17615 g/mol.
Where can I buy Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate?
You can request a quote for Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate?
Yes, CoreyChem provides custom synthesis services for Urea, 1-(2-diethylaminoacetyl)-3-(1-indanyl)-, picrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.