1-(Ethylsulfanyl)-4-methylphthalazine
TL;DR: 1-(Ethylsulfanyl)-4-methylphthalazine (CAS 68775-89-3) is a chemical compound with molecular formula C11H12N2S and molecular weight 204.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethylsulfanyl-4-methylphthalazine
Also Known As: TimTec1_002180, 1-(ethylsulfanyl)-4-methylphthalazine, 1-ethylthio-4-methylphthalazine, 1-ethylsulfanyl-4-methylphthalazine, 1-(ethylthio)-4-methylphthalazine
| Molecular Formula | C11H12N2S |
|---|---|
| Molecular Weight | 204.07 g/mol |
| LogP | 3.05022 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.07211 |
| Heavy Atoms | 14 |
| Complexity | 453.98184 |
Chemical Identifiers
| CAS Number | 68775-89-3 |
|---|---|
| SMILES | CCSC1=NN=C(C2=CC=CC=C21)C |
Product Overview
1-(Ethylsulfanyl)-4-methylphthalazine (CAS 68775-89-3), with molecular formula C11H12N2S and molecular weight 204.07 g/mol. IUPAC: 1-ethylsulfanyl-4-methylphthalazine.
Chemical Property Profile of 1-(Ethylsulfanyl)-4-methylphthalazine
Property Insights of 1-(Ethylsulfanyl)-4-methylphthalazine
The XLogP value of 3.05022 indicates that 1-(Ethylsulfanyl)-4-methylphthalazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, 1-(Ethylsulfanyl)-4-methylphthalazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Ethylsulfanyl)-4-methylphthalazine 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 1-(Ethylsulfanyl)-4-methylphthalazine?
The CAS number of 1-(Ethylsulfanyl)-4-methylphthalazine is 68775-89-3.
What is the molecular formula of 1-(Ethylsulfanyl)-4-methylphthalazine?
The molecular formula of 1-(Ethylsulfanyl)-4-methylphthalazine is C11H12N2S.
What is the molecular weight of 1-(Ethylsulfanyl)-4-methylphthalazine?
The molecular weight of 1-(Ethylsulfanyl)-4-methylphthalazine is 204.07 g/mol.
Where can I buy 1-(Ethylsulfanyl)-4-methylphthalazine?
You can request a quote for 1-(Ethylsulfanyl)-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-(Ethylsulfanyl)-4-methylphthalazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Ethylsulfanyl)-4-methylphthalazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.