1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione
TL;DR: 1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione (CAS 33607-57-7) is a chemical compound with molecular formula C19H18N2O2S and molecular weight 338.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dibenzyl-6,6a-dihydro-3aH-thieno[3,4-d]imidazole-2,4-dione
Also Known As: KST-1B3392, 1,3-dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione, AQ-193/41128876, cis-1,3-Dibenzylhexahydro-1H-thieno[3,4-d]imidazole-2,4-dione, 1,3-dibenzyl-2,4-dioxohexahydrothieno[3,4-d]imidazole
| Molecular Formula | C19H18N2O2S |
|---|---|
| Molecular Weight | 338.11 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 65.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 338.1089 |
| Heavy Atoms | 24 |
| Complexity | 486.0 |
Chemical Identifiers
| CAS Number | 33607-57-7 |
|---|---|
| SMILES | C1C2C(C(=O)S1)N(C(=O)N2CC3=CC=CC=C3)CC4=CC=CC=C4 |
| InChIKey | XJZIDYQGGLZUIO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione (CAS 33607-57-7), with molecular formula C19H18N2O2S and molecular weight 338.11 g/mol. IUPAC: 1,3-dibenzyl-6,6a-dihydro-3aH-thieno[3,4-d]imidazole-2,4-dione.
Chemical Property Profile of 1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione
Property Insights of 1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione. The TPSA of 65.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione. Following Lipinski's Rule of Five, 1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione 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
Frequently Asked Questions
What is the CAS number of 1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione?
The CAS number of 1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione is 33607-57-7.
What is the molecular formula of 1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione?
The molecular formula of 1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione is C19H18N2O2S.
What is the molecular weight of 1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione?
The molecular weight of 1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione is 338.11 g/mol.
Where can I buy 1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione?
You can request a quote for 1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dibenzyltetrahydro-1h-thieno[3,4-d]imidazole-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.