N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide
TL;DR: N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide (CAS 135718-57-9) is a chemical compound with molecular formula C18H19N3OS2 and molecular weight 357.09695 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-phenyl-2-sulfanylidene-1,4,5,6,7,8-hexahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetamide
Also Known As: N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide, Acetamide, N-(1,4,5,6,7,8-hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)-, 3,4,5,6,7,8-Hexahydro-3-(acetylamino)-4-phenyl[1]benzothieno[2,3-d]pyrimidine-2-thiol, 3,4,5,6,7,8-Hexahydro-4-phenyl-3-[acetylamino][1]benzothieno[2,3-d]pyrimidine-2(1H)-thione, N-(4-Phenyl-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)ethanimidic acid
Technical Specifications
| Molecular Formula | C18H19N3OS2 |
| Molecular Weight | 357.09695 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 357.09695 Da |
| Heavy Atoms | 24 |
| Complexity | 508.0 |
| SMILES | CC(=O)NN1C(C2=C(NC1=S)SC3=C2CCCC3)C4=CC=CC=C4 |
| InChIKey | NHZJHIQPMHYCSY-UHFFFAOYSA-N |
Chemical Property Profile of N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide
Property Insights of N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide
The XLogP value of 3.7 indicates that N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide. Following Lipinski's Rule of Five, N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide?
The CAS number of N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide is 135718-57-9.
What is the molecular formula of N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide?
The molecular formula of N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide is C18H19N3OS2.
What is the molecular weight of N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide?
The molecular weight of N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide is 357.09695 g/mol.
Where can I buy N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide?
You can request a quote for N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide?
Yes, CoreyChem provides custom synthesis services for N-(1,4,5,6,7,8-Hexahydro-4-phenyl-2-thioxo(1)benzothieno(2,3-d)pyrimidin-3(2H)-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.