(2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide
TL;DR: (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide (CAS 1632478-75-1) is a chemical compound with molecular formula C19H20N2S and molecular weight 308.1347 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide
Also Known As: BAS 00329324, BIM-0027552.P001, BRD-K68524074-001-01-2, (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide, (2Z)-2-(3,3-DIMETHYL-3,4-DIHYDRO-1(2H)-ISOQUINOLINYLIDENE)-N-PHENYLETHANETHIOAMIDE
Technical Specifications
| Molecular Formula | C19H20N2S |
| Molecular Weight | 308.1347 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 56.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 308.1347 Da |
| Heavy Atoms | 22 |
| Complexity | 435.0 |
| SMILES | CC1(CC2=CC=CC=C2/C(=C/C(=S)NC3=CC=CC=C3)/N1)C |
| InChIKey | VAXWYRLBLDKIQK-ATVHPVEESA-N |
Chemical Property Profile of (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide
Property Insights of (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide
The XLogP value of 4.2 indicates that (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.2 Ų, (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide?
The CAS number of (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide is 1632478-75-1.
What is the molecular formula of (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide?
The molecular formula of (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide is C19H20N2S.
What is the molecular weight of (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide?
The molecular weight of (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide is 308.1347 g/mol.
Where can I buy (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide?
You can request a quote for (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide?
Yes, CoreyChem provides custom synthesis services for (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-phenylethanethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.