5-(3-Nitrobenzylidene)imidazolidine-2,4-dione
TL;DR: 5-(3-Nitrobenzylidene)imidazolidine-2,4-dione (CAS 10040-89-8) is a chemical compound with molecular formula C10H7N3O4 and molecular weight 233.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3-nitrophenyl)methylidene]imidazolidine-2,4-dione
Also Known As: m-nitrobenzalhydantoin, 3-nitro-benzylidene-hydantoin, 5-(3-nitrobenzylidene)imidazolidine-2,4-dione, 2,5-Diazabicyclo<2.2.2>octan-3,6-dion, 5-[(3-nitrophenyl)methylidene]imidazolidine-2,4-dione
| Molecular Formula | C10H7N3O4 |
|---|---|
| Molecular Weight | 233.04 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 233.04366 |
| Heavy Atoms | 17 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 10040-89-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C=C2C(=O)NC(=O)N2 |
| InChIKey | UXLLZDWZJYMJKG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(3-Nitrobenzylidene)imidazolidine-2,4-dione (CAS 10040-89-8), with molecular formula C10H7N3O4 and molecular weight 233.04 g/mol. IUPAC: 5-[(3-nitrophenyl)methylidene]imidazolidine-2,4-dione.
Chemical Property Profile of 5-(3-Nitrobenzylidene)imidazolidine-2,4-dione
Property Insights of 5-(3-Nitrobenzylidene)imidazolidine-2,4-dione
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(3-Nitrobenzylidene)imidazolidine-2,4-dione. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(3-Nitrobenzylidene)imidazolidine-2,4-dione. Following Lipinski's Rule of Five, 5-(3-Nitrobenzylidene)imidazolidine-2,4-dione has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-(3-Nitrobenzylidene)imidazolidine-2,4-dione?
The CAS number of 5-(3-Nitrobenzylidene)imidazolidine-2,4-dione is 10040-89-8.
What is the molecular formula of 5-(3-Nitrobenzylidene)imidazolidine-2,4-dione?
The molecular formula of 5-(3-Nitrobenzylidene)imidazolidine-2,4-dione is C10H7N3O4.
What is the molecular weight of 5-(3-Nitrobenzylidene)imidazolidine-2,4-dione?
The molecular weight of 5-(3-Nitrobenzylidene)imidazolidine-2,4-dione is 233.04 g/mol.
Where can I buy 5-(3-Nitrobenzylidene)imidazolidine-2,4-dione?
You can request a quote for 5-(3-Nitrobenzylidene)imidazolidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(3-Nitrobenzylidene)imidazolidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(3-Nitrobenzylidene)imidazolidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.