![1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine structure](/static/products/300/300675-07-4.png)
1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine
TL;DR: 1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine (CAS 300675-07-4) is a chemical compound with molecular formula C16H12F2N2S and molecular weight 302.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(difluoromethylsulfanyl)-4-(4-methylphenyl)phthalazine
Also Known As: 1-[(difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine, difluoro[4-(4-methylphenyl)phthalazinylthio]methane, 1-(difluoromethylsulfanyl)-4-(4-methylphenyl)phthalazine
| Molecular Formula | C16H12F2N2S |
|---|---|
| Molecular Weight | 302.07 g/mol |
| LogP | 4.91992 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.06894 |
| Heavy Atoms | 21 |
| Complexity | 772.8339 |
Chemical Identifiers
| CAS Number | 300675-07-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SC(F)F |
Product Overview
1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine (CAS 300675-07-4), with molecular formula C16H12F2N2S and molecular weight 302.07 g/mol. IUPAC: 1-(difluoromethylsulfanyl)-4-(4-methylphenyl)phthalazine.
Chemical Property Profile of 1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine
Property Insights of 1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine
The XLogP value of 4.91992 indicates that 1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine 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-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine 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-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine?
The CAS number of 1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine is 300675-07-4.
What is the molecular formula of 1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine?
The molecular formula of 1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine is C16H12F2N2S.
What is the molecular weight of 1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine?
The molecular weight of 1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine is 302.07 g/mol.
Where can I buy 1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine?
You can request a quote for 1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(Difluoromethyl)sulfanyl]-4-(4-methylphenyl)phthalazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.