1-(1,3-Benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine
TL;DR: 1-(1,3-Benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine (CAS 373368-34-4) is a chemical compound with molecular formula C22H15N3S2 and molecular weight 385.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-methylphenyl)phthalazin-1-yl]sulfanyl-1,3-benzothiazole
Also Known As: 2-((4-(p-tolyl)phthalazin-1-yl)thio)benzo[d]thiazole, 1-(1,3-benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine, 2-[4-(4-methylphenyl)phthalazin-1-yl]sulfanyl-1,3-benzothiazole
| Molecular Formula | C22H15N3S2 |
|---|---|
| Molecular Weight | 385.07 g/mol |
| LogP | 6.36612 |
| Topological Polar Surface Area | 38.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 385.07074 |
| Heavy Atoms | 27 |
| Complexity | 1226.7937 |
Chemical Identifiers
| CAS Number | 373368-34-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SC4=NC5=CC=CC=C5S4 |
Product Overview
1-(1,3-Benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine (CAS 373368-34-4), with molecular formula C22H15N3S2 and molecular weight 385.07 g/mol. IUPAC: 2-[4-(4-methylphenyl)phthalazin-1-yl]sulfanyl-1,3-benzothiazole.
Chemical Property Profile of 1-(1,3-Benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine
Property Insights of 1-(1,3-Benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine
The XLogP value of 6.36612 indicates that 1-(1,3-Benzothiazol-2-ylsulfanyl)-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 38.67 Ų, 1-(1,3-Benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,3-Benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(1,3-Benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine?
The CAS number of 1-(1,3-Benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine is 373368-34-4.
What is the molecular formula of 1-(1,3-Benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine?
The molecular formula of 1-(1,3-Benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine is C22H15N3S2.
What is the molecular weight of 1-(1,3-Benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine?
The molecular weight of 1-(1,3-Benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine is 385.07 g/mol.
Where can I buy 1-(1,3-Benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine?
You can request a quote for 1-(1,3-Benzothiazol-2-ylsulfanyl)-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-(1,3-Benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzothiazol-2-ylsulfanyl)-4-(4-methylphenyl)phthalazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.