TL;DR: Hydantoin, 1-((5-(o-nitrophenyl)furfurylidene)amino)- (CAS 16118-13-1) is a chemical compound with molecular formula C14H10N4O5 and molecular weight 314.06512 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(E)-[5-(2-nitrophenyl)furan-2-yl]methylideneamino]imidazolidine-2,4-dione
Also Known As: o-Nitrodantrolene, Hydantoin, 1-((5-(o-nitrophenyl)furfurylidene)amino)-, 1-[[[5-(2-Nitrophenyl)-2-furanyl]methylene]amino]-2,4-imidazolidinedione, 1-[[5-(2-nitrophenyl)-2-furyl]methylideneamino]imidazolidine-2,4-dione, 1-({[5-(2-nitrophenyl)furan-2-yl]methylidene}amino)imidazolidine-2,4-dione
| Molecular Formula | C14H10N4O5 |
| Molecular Weight | 314.06512 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.06512 Da |
| Heavy Atoms | 23 |
| Complexity | 532.0 |
| SMILES | C1C(=O)NC(=O)N1/N=C/C2=CC=C(O2)C3=CC=CC=C3[N+](=O)[O-] |
| InChIKey | LCKIOUHLSZHAQG-VIZOYTHASA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydantoin, 1-((5-(o-nitrophenyl)furfurylidene)amino)-. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydantoin, 1-((5-(o-nitrophenyl)furfurylidene)amino)-. Following Lipinski's Rule of Five, Hydantoin, 1-((5-(o-nitrophenyl)furfurylidene)amino)- has 1 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 Hydantoin, 1-((5-(o-nitrophenyl)furfurylidene)amino)- is 16118-13-1.
The molecular formula of Hydantoin, 1-((5-(o-nitrophenyl)furfurylidene)amino)- is C14H10N4O5.
The molecular weight of Hydantoin, 1-((5-(o-nitrophenyl)furfurylidene)amino)- is 314.06512 g/mol.
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