(5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one
TL;DR: (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one (CAS 677295-35-1) is a chemical compound with molecular formula C19H16N2OS and molecular weight 320.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-benzylidene-2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-thiazol-4-one
Also Known As: (Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)thiazol-4(5H)-one, (5Z)-5-benzylidene-2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-thiazol-4-one, (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one, (5Z)-5-(PHENYLMETHYLIDENE)-2-(1,2,3,4-TETRAHYDROISOQUINOLIN-2-YL)-4,5-DIHYDRO-1,3-THIAZOL-4-ONE
| Molecular Formula | C19H16N2OS |
|---|---|
| Molecular Weight | 320.10 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 58.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 320.09833 |
| Heavy Atoms | 23 |
| Complexity | 521.0 |
Chemical Identifiers
| CAS Number | 677295-35-1 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)C3=NC(=O)/C(=C/C4=CC=CC=C4)/S3 |
| InChIKey | GAHSXWJRAXSBGC-ATVHPVEESA-N |
Product Overview
(5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one (CAS 677295-35-1), with molecular formula C19H16N2OS and molecular weight 320.10 g/mol. IUPAC: (5Z)-5-benzylidene-2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-thiazol-4-one.
Chemical Property Profile of (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one
Property Insights of (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one
The XLogP value of 4.0 indicates that (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.0 Ų, (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one has 0 hydrogen bond donor(s) and 2 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 (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one?
The CAS number of (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one is 677295-35-1.
What is the molecular formula of (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one?
The molecular formula of (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one is C19H16N2OS.
What is the molecular weight of (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one?
The molecular weight of (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one is 320.10 g/mol.
Where can I buy (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one?
You can request a quote for (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-5-benzylidene-2-(3,4-dihydroisoquinolin-2(1H)-yl)-1,3-thiazol-4(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.