(S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 1212484-30-4) is a chemical compound with molecular formula C25H31N3O5S and molecular weight 485.19846 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-1,3-dimethyl-5-[(5-methylthiophen-2-yl)methyl]-1,3-diazinane-2,4,6-trione
Also Known As: (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione, 5-[[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-1,3-dimethyl-5-[(5-methylthiophen-2-yl)methyl]-1,3-diazinane-2,4,6-trione
Technical Specifications
| Molecular Formula | C25H31N3O5S |
| Molecular Weight | 485.19846 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 108.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 485.19846 Da |
| Heavy Atoms | 34 |
| Complexity | 785.0 |
| SMILES | C[C@H]1C2=CC(=C(C=C2CCN1CC3(C(=O)N(C(=O)N(C3=O)C)C)CC4=CC=C(S4)C)OC)OC |
| InChIKey | FHCZYRRRJLFSLZ-INIZCTEOSA-N |
Chemical Property Profile of (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 3.0 indicates that (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 1212484-30-4.
What is the molecular formula of (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione is C25H31N3O5S.
What is the molecular weight of (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 485.19846 g/mol.
Where can I buy (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, CoreyChem provides custom synthesis services for (S)-5-((6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl)-1,3-dimethyl-5-((5-methylthiophen-2-yl)methyl)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.