![(3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one structure](/static/products/2809/28092-54-8.webp)
(3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one
TL;DR: (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one (CAS 28092-54-8) is a chemical compound with molecular formula C23H26N2O2S and molecular weight 394.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aS,6aR)-1,3-dibenzyl-4-(3-methoxypropylidene)-6,6a-dihydro-3aH-thieno[3,4-d]imidazol-2-one
Also Known As: (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one, (3aS,6aR)-Tetrahydro-4-(3-methoxypropylidene)-1,3-bis(phenylmethyl)-1H-thieno[3,4-d]imidazol-2(3H)-one
| Molecular Formula | C23H26N2O2S |
|---|---|
| Molecular Weight | 394.17 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 58.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 394.1715 |
| Heavy Atoms | 28 |
| Complexity | 555.0 |
Chemical Identifiers
| CAS Number | 28092-54-8 |
|---|---|
| SMILES | COCCC=C1[C@@H]2[C@H](CS1)N(C(=O)N2CC3=CC=CC=C3)CC4=CC=CC=C4 |
| InChIKey | OTOVKAPQUJOUHD-UNMCSNQZSA-N |
Product Overview
(3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one (CAS 28092-54-8), with molecular formula C23H26N2O2S and molecular weight 394.17 g/mol. IUPAC: (3aS,6aR)-1,3-dibenzyl-4-(3-methoxypropylidene)-6,6a-dihydro-3aH-thieno[3,4-d]imidazol-2-one.
Chemical Property Profile of (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one
Property Insights of (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one
The XLogP value of 3.3 indicates that (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.1 Ų, (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one 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 (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one?
The CAS number of (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one is 28092-54-8.
What is the molecular formula of (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one?
The molecular formula of (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one is C23H26N2O2S.
What is the molecular weight of (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one?
The molecular weight of (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one is 394.17 g/mol.
Where can I buy (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one?
You can request a quote for (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for (3aS,6aR)-1,3-Dibenzyl-4-(3-methoxypropylidene)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.