(S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline)
TL;DR: (S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline) (CAS 133463-88-4) is a chemical compound with molecular formula C20H20N2O2 and molecular weight 320.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S)-4-benzyl-2-[(4S)-4-benzyl-4,5-dihydro-1,3-oxazol-2-yl]-4,5-dihydro-1,3-oxazole
Also Known As: 2,2'-Bis[(4S)-4-benzyl-2-oxazoline], Clomazone, (S,S)-Bn-Bisbox, (4S,4'S)-4,4'-dibenzyl-4,4',5,5'-tetrahydro-2,2'-bioxazole, (S,S)-2,2'-Bis(4-benzyl-2-oxazoline)
| Molecular Formula | C20H20N2O2 |
|---|---|
| Molecular Weight | 320.15 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 43.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 320.15247 |
| Heavy Atoms | 24 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 133463-88-4 |
|---|---|
| SMILES | C1[C@@H](N=C(O1)C2=N[C@H](CO2)CC3=CC=CC=C3)CC4=CC=CC=C4 |
| InChIKey | OIEQQWQZUYZCRJ-ROUUACIJSA-N |
Product Overview
(S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline) (CAS 133463-88-4), with molecular formula C20H20N2O2 and molecular weight 320.15 g/mol. IUPAC: (4S)-4-benzyl-2-[(4S)-4-benzyl-4,5-dihydro-1,3-oxazol-2-yl]-4,5-dihydro-1,3-oxazole.
Chemical Property Profile of (S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline)
Property Insights of (S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline)
The XLogP value of 3.7 indicates that (S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.2 Ų, (S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline) has 0 hydrogen bond donor(s) and 4 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 (S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline)?
The CAS number of (S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline) is 133463-88-4.
What is the molecular formula of (S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline)?
The molecular formula of (S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline) is C20H20N2O2.
What is the molecular weight of (S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline)?
The molecular weight of (S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline) is 320.15 g/mol.
Where can I buy (S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline)?
You can request a quote for (S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline)?
Yes, KEHONG BIO provides custom synthesis services for (S,S)-4,4'-Dibenzyl-2,2'-bi(2-oxazoline) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.