RefChem:203881
TL;DR: RefChem:203881 (CAS 128352-88-5) is a chemical compound with molecular formula C23H22N2S2 and molecular weight 390.12244 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-benzyl-4-phenyl-1,4,5,6,7,8-hexahydro-[1]benzothiolo[2,3-d]pyrimidine-2-thione
Also Known As: 3,4,5,6,7,8-Hexahydro-4-phenyl-3-(phenylmethyl)-(1)benzothieno(2,3-d)pyrimidine-2(1H)-thione, (1)Benzothieno(2,3-d)pyrimidine-2(1H)-thione, 3,4,5,6,7,8-hexahydro-4-phenyl-3-(phenylmethyl)-, 3,4,5,6,7,8-Hexahydro-3-benzyl-4-phenyl[1]benzothieno[2,3-d]pyrimidine-2-thiol, 3-Benzyl-3,4,5,6,7,8-hexahydro-4-phenyl[1]benzothieno[2,3-d]pyrimidine-2(1H)-thione, 3-benzyl-4-phenyl-1,4,5,6,7,8-hexahydro-[1]benzothiolo[2,3-d]pyrimidine-2-thione
Technical Specifications
| Molecular Formula | C23H22N2S2 |
| Molecular Weight | 390.12244 g/mol |
| XLogP | 5.7 |
| Topological Polar Surface Area (TPSA) | 75.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 390.12244 Da |
| Heavy Atoms | 27 |
| Complexity | 526.0 |
| SMILES | C1CCC2=C(C1)C3=C(S2)NC(=S)N(C3C4=CC=CC=C4)CC5=CC=CC=C5 |
| InChIKey | WRUQTEQLHAJIRW-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:203881
Property Insights of RefChem:203881
The XLogP value of 5.7 indicates that RefChem:203881 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:203881. Following Lipinski's Rule of Five, RefChem:203881 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:203881?
The CAS number of RefChem:203881 is 128352-88-5.
What is the molecular formula of RefChem:203881?
The molecular formula of RefChem:203881 is C23H22N2S2.
What is the molecular weight of RefChem:203881?
The molecular weight of RefChem:203881 is 390.12244 g/mol.
Where can I buy RefChem:203881?
You can request a quote for RefChem:203881 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:203881?
Yes, CoreyChem provides custom synthesis services for RefChem:203881 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.