1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione
TL;DR: 1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione (CAS 669757-38-4) is a chemical compound with molecular formula C10H10N4O4 and molecular weight 250.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione
Also Known As: 1,2-dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione, 1,2,4-Triazolidine-3,5-dione, 1,2-dimethyl-4-(4-nitrophenyl)-, A3328/0141299
| Molecular Formula | C10H10N4O4 |
|---|---|
| Molecular Weight | 250.07 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 89.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 250.0702 |
| Heavy Atoms | 18 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 669757-38-4 |
|---|---|
| SMILES | CN1C(=O)N(C(=O)N1C)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | UZSFDHCVDQTTID-UHFFFAOYSA-N |
Product Overview
1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione (CAS 669757-38-4), with molecular formula C10H10N4O4 and molecular weight 250.07 g/mol. IUPAC: 1,2-dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione.
Chemical Property Profile of 1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione
Property Insights of 1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione. The TPSA of 89.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione. Following Lipinski's Rule of Five, 1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione has 0 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 1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione?
The CAS number of 1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione is 669757-38-4.
What is the molecular formula of 1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione?
The molecular formula of 1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione is C10H10N4O4.
What is the molecular weight of 1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione?
The molecular weight of 1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione is 250.07 g/mol.
Where can I buy 1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione?
You can request a quote for 1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dimethyl-4-(4-nitrophenyl)-1,2,4-triazolidine-3,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.