Xrd 489
TL;DR: Xrd 489 (CAS 98937-00-9) is a chemical compound with molecular formula C13H11Cl2N5O2S and molecular weight 371.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,6-dichlorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide
Also Known As: D 489 (herbicide), DTPS, N-(2,6-dichlorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide, AN-646/14363005, (1,2,4)Triazolo(1,5-a)pyrimidine-2-sulfonamide, N-(2,6-dichlorophenyl)-5,7-dimethyl-
| Molecular Formula | C13H11Cl2N5O2S |
|---|---|
| Molecular Weight | 371.00 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 97.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 371.00104 |
| Heavy Atoms | 23 |
| Complexity | 521.0 |
Chemical Identifiers
| CAS Number | 98937-00-9 |
|---|---|
| SMILES | CC1=CC(=NC2=NC(=NN12)S(=O)(=O)NC3=C(C=CC=C3Cl)Cl)C |
| InChIKey | RZWWGOCLMSGROE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Xrd 489 (CAS 98937-00-9), with molecular formula C13H11Cl2N5O2S and molecular weight 371.00 g/mol. IUPAC: N-(2,6-dichlorophenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide.
Chemical Property Profile of Xrd 489
Property Insights of Xrd 489
The XLogP value of 3.0 indicates that Xrd 489 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Xrd 489. Following Lipinski's Rule of Five, Xrd 489 has 1 hydrogen bond donor(s) and 6 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 Xrd 489?
The CAS number of Xrd 489 is 98937-00-9.
What is the molecular formula of Xrd 489?
The molecular formula of Xrd 489 is C13H11Cl2N5O2S.
What is the molecular weight of Xrd 489?
The molecular weight of Xrd 489 is 371.00 g/mol.
Where can I buy Xrd 489?
You can request a quote for Xrd 489 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Xrd 489?
Yes, KEHONG BIO provides custom synthesis services for Xrd 489 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.