RefChem:203887
TL;DR: RefChem:203887 (CAS 128368-39-8) is a chemical compound with molecular formula C22H25N3S2 and molecular weight 395.149 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-phenyl-3-(2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-2-thione
Also Known As: (1)Benzothieno(2,3-d)pyrimidine-2(3H)-thione, 5,6,7,8-tetrahydro-4-phenyl-3-(2-pyrrolidinyl)ethyl)-, 3-[2-(1-Pyrrolidinyl)ethyl]-5,6,7,8-tetrahydro-4-phenyl[1]benzothieno[2,3-d]pyrimidine-2(3H)-thione, 3-phenyl-4-[2-(pyrrolidin-1-yl)ethyl]-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,6-triene-5-thione, 4-phenyl-3-(2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-2-thione, 4-Phenyl-3-[2-(pyrrolidin-1-yl)ethyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2(3H)-thione
Technical Specifications
| Molecular Formula | C22H25N3S2 |
| Molecular Weight | 395.149 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 76.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 395.149 Da |
| Heavy Atoms | 27 |
| Complexity | 709.0 |
| SMILES | C1CCC2=C(C1)C3=C(N(C(=S)N=C3S2)CCN4CCCC4)C5=CC=CC=C5 |
| InChIKey | XRPYAVAJZMYYBL-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:203887
Property Insights of RefChem:203887
The XLogP value of 4.1 indicates that RefChem:203887 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:203887. Following Lipinski's Rule of Five, RefChem:203887 has 0 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 RefChem:203887?
The CAS number of RefChem:203887 is 128368-39-8.
What is the molecular formula of RefChem:203887?
The molecular formula of RefChem:203887 is C22H25N3S2.
What is the molecular weight of RefChem:203887?
The molecular weight of RefChem:203887 is 395.149 g/mol.
Where can I buy RefChem:203887?
You can request a quote for RefChem:203887 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:203887?
Yes, CoreyChem provides custom synthesis services for RefChem:203887 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.