TL;DR: N-acridin-9-ylaspartic acid (CAS 1396968-60-7) is a chemical compound with molecular formula C17H14N2O4 and molecular weight 310.09537 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(acridin-9-ylamino)butanedioic acid
Also Known As: N-acridin-9-ylaspartic acid, 2-(acridin-9-ylamino)butanedioic Acid, 2-(acridin-9-ylamino)succinic acid
| Molecular Formula | C17H14N2O4 |
| Molecular Weight | 310.09537 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 99.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 310.09537 Da |
| Heavy Atoms | 23 |
| Complexity | 434.0 |
| SMILES | C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC(CC(=O)O)C(=O)O |
| InChIKey | KUHSGINPXZXEEB-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that N-acridin-9-ylaspartic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-acridin-9-ylaspartic acid. Following Lipinski's Rule of Five, N-acridin-9-ylaspartic acid has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-acridin-9-ylaspartic acid is 1396968-60-7.
The molecular formula of N-acridin-9-ylaspartic acid is C17H14N2O4.
The molecular weight of N-acridin-9-ylaspartic acid is 310.09537 g/mol.
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