BAS 11788031
TL;DR: BAS 11788031 (CAS 876889-26-8) is a chemical compound with molecular formula C23H26ClN3O2 and molecular weight 411.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-4-[1-[2-(4-chlorophenoxy)ethyl]benzimidazol-2-yl]pyrrolidin-2-one
Also Known As: BAS 11788031, UPCMLD0ENAT5816104:001, VU0493100-1, 1-tert-butyl-4-{1-[2-(4-chlorophenoxy)ethyl]-1H-1,3-benzodiazol-2-yl}pyrrolidin-2-one, F3243-0618
| Molecular Formula | C23H26ClN3O2 |
|---|---|
| Molecular Weight | 411.17 g/mol |
| LogP | 4.8831 |
| Topological Polar Surface Area | 47.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.17136 |
| Heavy Atoms | 29 |
| Complexity | 1020.7741 |
Chemical Identifiers
| CAS Number | 876889-26-8 |
|---|---|
| SMILES | CC(C)(C)N1CC(CC1=O)C2=NC3=CC=CC=C3N2CCOC4=CC=C(C=C4)Cl |
Product Overview
BAS 11788031 (CAS 876889-26-8), with molecular formula C23H26ClN3O2 and molecular weight 411.17 g/mol. IUPAC: 1-tert-butyl-4-[1-[2-(4-chlorophenoxy)ethyl]benzimidazol-2-yl]pyrrolidin-2-one.
Chemical Property Profile of BAS 11788031
Property Insights of BAS 11788031
The XLogP value of 4.8831 indicates that BAS 11788031 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.36 Ų, BAS 11788031 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 11788031 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 BAS 11788031?
The CAS number of BAS 11788031 is 876889-26-8.
What is the molecular formula of BAS 11788031?
The molecular formula of BAS 11788031 is C23H26ClN3O2.
What is the molecular weight of BAS 11788031?
The molecular weight of BAS 11788031 is 411.17 g/mol.
Where can I buy BAS 11788031?
You can request a quote for BAS 11788031 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 11788031?
Yes, KEHONG BIO provides custom synthesis services for BAS 11788031 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.