1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine
TL;DR: 1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine (CAS 337925-47-0) is a chemical compound with molecular formula C15H14N4S and molecular weight 282.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine
Also Known As: ChemDiv1_004851, 1-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine, 1-[(4,6-Dimethyl-2-pyrimidinyl)sulfanyl]-4-methylphthalazine, 1-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-4-methylphthalazine, 1-(4,6-dimethylpyrimidin-2-ylthio)-4-methylphthalazine
| Molecular Formula | C15H14N4S |
|---|---|
| Molecular Weight | 282.09 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 76.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.0939 |
| Heavy Atoms | 20 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 337925-47-0 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)SC2=NN=C(C3=CC=CC=C32)C)C |
| InChIKey | NQLZBBBSDVKSRL-UHFFFAOYSA-N |
Product Overview
1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine (CAS 337925-47-0), with molecular formula C15H14N4S and molecular weight 282.09 g/mol. IUPAC: 1-(4,6-dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine.
Chemical Property Profile of 1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine
Property Insights of 1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine
The XLogP value of 3.3 indicates that 1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine. Following Lipinski's Rule of Five, 1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine has 0 hydrogen bond donor(s) and 5 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-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine?
The CAS number of 1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine is 337925-47-0.
What is the molecular formula of 1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine?
The molecular formula of 1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine is C15H14N4S.
What is the molecular weight of 1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine?
The molecular weight of 1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine is 282.09 g/mol.
Where can I buy 1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine?
You can request a quote for 1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4,6-Dimethylpyrimidin-2-yl)sulfanyl-4-methylphthalazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.