(10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
TL;DR: (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one (CAS 724748-58-7) is a chemical compound with molecular formula C26H20N2OS3 and molecular weight 472.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(14Z)-11-(4-methylsulfanylphenyl)-14-(thiophen-2-ylmethylidene)-15-thia-12,17-diazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,16-pentaen-13-one
Also Known As: (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one, (Z)-7-(4-(methylthio)phenyl)-10-(thiophen-2-ylmethylene)-7,10-dihydro-5H-benzo[h]thiazolo[2,3-b]quinazolin-9(6H)-one
| Molecular Formula | C26H20N2OS3 |
|---|---|
| Molecular Weight | 472.07 g/mol |
| LogP | 5.1021 |
| Topological Polar Surface Area | 34.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 472.0738 |
| Heavy Atoms | 32 |
| Complexity | 1523.1296 |
Chemical Identifiers
| CAS Number | 724748-58-7 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)C2C3=C(C4=CC=CC=C4CC3)N=C5N2C(=O)/C(=C/C6=CC=CS6)/S5 |
Product Overview
(10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one (CAS 724748-58-7), with molecular formula C26H20N2OS3 and molecular weight 472.07 g/mol. IUPAC: (14Z)-11-(4-methylsulfanylphenyl)-14-(thiophen-2-ylmethylidene)-15-thia-12,17-diazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,16-pentaen-13-one.
Chemical Property Profile of (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Property Insights of (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
The XLogP value of 5.1021 indicates that (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.36 Ų, (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one 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 (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one?
The CAS number of (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one is 724748-58-7.
What is the molecular formula of (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one?
The molecular formula of (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one is C26H20N2OS3.
What is the molecular weight of (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one?
The molecular weight of (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one is 472.07 g/mol.
Where can I buy (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one?
You can request a quote for (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one?
Yes, KEHONG BIO provides custom synthesis services for (10Z)-7-[4-(methylsulfanyl)phenyl]-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.