6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione
TL;DR: 6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione (CAS 3678-19-1) is a chemical compound with molecular formula C11H6ClN3O3 and molecular weight 263.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-chlorophenyl)-6H-[1,3]oxazolo[3,2-a][1,3,5]triazine-4,7-dione
Also Known As: 3-methoxycarbonyl-2-phenylindole, 6-(2-chlorophenyl)-4h-[1,3]oxazolo[3,2-a][1,3,5]triazine-4,7(6h)-dione, 6-(o-Chlorophenyl)oxazolo(3,2-a)-sym-triazine-5,7-dione, Oxazolo(3,2-a)-sym-triazine-5,7-dione, 6-(o-chlorophenyl)-, 6-(2-Chlorophenyl)-4H-oxazolo[3,2-a][1,3,5]triazine-4,7(6H)-dione
| Molecular Formula | C11H6ClN3O3 |
|---|---|
| Molecular Weight | 263.01 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 71.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 263.00977 |
| Heavy Atoms | 18 |
| Complexity | 462.0 |
Chemical Identifiers
| CAS Number | 3678-19-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2C(=O)OC3=NC=NC(=O)N23)Cl |
| InChIKey | PSOXJXIXRPKCEP-UHFFFAOYSA-N |
Product Overview
6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione (CAS 3678-19-1), with molecular formula C11H6ClN3O3 and molecular weight 263.01 g/mol. IUPAC: 6-(2-chlorophenyl)-6H-[1,3]oxazolo[3,2-a][1,3,5]triazine-4,7-dione.
Chemical Property Profile of 6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione
Property Insights of 6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione. The TPSA of 71.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione. Following Lipinski's Rule of Five, 6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione has 0 hydrogen bond donor(s) and 3 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 6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione?
The CAS number of 6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione is 3678-19-1.
What is the molecular formula of 6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione?
The molecular formula of 6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione is C11H6ClN3O3.
What is the molecular weight of 6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione?
The molecular weight of 6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione is 263.01 g/mol.
Where can I buy 6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione?
You can request a quote for 6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-(2-Chlorophenyl)-4H-(1,3)oxazolo(3,2-a)(1,3,5)triazine-4,7(6H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.