Prometryn sulfoxide
TL;DR: Prometryn sulfoxide (CAS 55702-48-2) is a chemical compound with molecular formula C10H19N5OS and molecular weight 257.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methylsulfinyl-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine
Also Known As: Prometrynsulfoxide, Prometryn sulfoxide, EX-A9619, GS 16141, 1,3,5-Triazine-2,4-diamine, N,N'-bis(1-methylethyl)-6-(methylsulfinyl)-
| Molecular Formula | C10H19N5OS |
|---|---|
| Molecular Weight | 257.13 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 99.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 257.13104 |
| Heavy Atoms | 17 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 55702-48-2 |
|---|---|
| SMILES | CC(C)NC1=NC(=NC(=N1)S(=O)C)NC(C)C |
| InChIKey | HQYUMPWBGTUHSK-UHFFFAOYSA-N |
Product Overview
Prometryn sulfoxide (CAS 55702-48-2), with molecular formula C10H19N5OS and molecular weight 257.13 g/mol. IUPAC: 6-methylsulfinyl-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine.
Chemical Property Profile of Prometryn sulfoxide
Property Insights of Prometryn sulfoxide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Prometryn sulfoxide. The TPSA of 99.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Prometryn sulfoxide. Following Lipinski's Rule of Five, Prometryn sulfoxide has 2 hydrogen bond donor(s) and 7 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 Prometryn sulfoxide?
The CAS number of Prometryn sulfoxide is 55702-48-2.
What is the molecular formula of Prometryn sulfoxide?
The molecular formula of Prometryn sulfoxide is C10H19N5OS.
What is the molecular weight of Prometryn sulfoxide?
The molecular weight of Prometryn sulfoxide is 257.13 g/mol.
Where can I buy Prometryn sulfoxide?
You can request a quote for Prometryn sulfoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Prometryn sulfoxide?
Yes, KEHONG BIO provides custom synthesis services for Prometryn sulfoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.