TL;DR: 9(10H)-Acridinone, 4-((2-aminoethyl)amino)-1-nitro- (CAS 128071-39-6) is a chemical compound with molecular formula C15H14N4O3 and molecular weight 298.1066 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-aminoethylamino)-1-nitro-10H-acridin-9-one
Also Known As: 9(10H)-Acridinone, 4-((2-aminoethyl)amino)-1-nitro-, 4-((2-Aminoethyl)amino)-1-nitro-9(10H)-acridinone, 4-(2-aminoethylamino)-1-nitro-10H-acridin-9-one, 4-((2-Aminoethyl)amino)-1-nitroacridin-9(10H)-one, 9(10H)-Acridinone,4-[(2-aminoethyl)amino]-1-nitro-
| Molecular Formula | C15H14N4O3 |
| Molecular Weight | 298.1066 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.1066 Da |
| Heavy Atoms | 22 |
| Complexity | 439.0 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3N2)NCCN)[N+](=O)[O-] |
| InChIKey | GKIRIKIDXIXOKE-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9(10H)-Acridinone, 4-((2-aminoethyl)amino)-1-nitro-. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 9(10H)-Acridinone, 4-((2-aminoethyl)amino)-1-nitro-. Following Lipinski's Rule of Five, 9(10H)-Acridinone, 4-((2-aminoethyl)amino)-1-nitro- 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 9(10H)-Acridinone, 4-((2-aminoethyl)amino)-1-nitro- is 128071-39-6.
The molecular formula of 9(10H)-Acridinone, 4-((2-aminoethyl)amino)-1-nitro- is C15H14N4O3.
The molecular weight of 9(10H)-Acridinone, 4-((2-aminoethyl)amino)-1-nitro- is 298.1066 g/mol.
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