BAS 13174698
TL;DR: BAS 13174698 (CAS 874615-49-3) is a chemical compound with molecular formula C27H27N3O3 and molecular weight 441.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-ethoxyphenyl)-4-[1-(2-phenoxyethyl)benzimidazol-2-yl]pyrrolidin-2-one
Also Known As: BAS 13174698, 1-(4-ethoxyphenyl)-4-[1-(2-phenoxyethyl)-1H-1,3-benzodiazol-2-yl]pyrrolidin-2-one, D125-2210, 1-(4-ethoxyphenyl)-4-[1-(2-phenoxyethyl)benzimidazol-2-yl]pyrrolidin-2-one, F3141-0082
| Molecular Formula | C27H27N3O3 |
|---|---|
| Molecular Weight | 441.21 g/mol |
| LogP | 5.0345 |
| Topological Polar Surface Area | 56.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 441.20523 |
| Heavy Atoms | 33 |
| Complexity | 1234.7089 |
Chemical Identifiers
| CAS Number | 874615-49-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2CC(CC2=O)C3=NC4=CC=CC=C4N3CCOC5=CC=CC=C5 |
Product Overview
BAS 13174698 (CAS 874615-49-3), with molecular formula C27H27N3O3 and molecular weight 441.21 g/mol. IUPAC: 1-(4-ethoxyphenyl)-4-[1-(2-phenoxyethyl)benzimidazol-2-yl]pyrrolidin-2-one.
Chemical Property Profile of BAS 13174698
Property Insights of BAS 13174698
The XLogP value of 5.0345 indicates that BAS 13174698 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.59 Ų, BAS 13174698 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 13174698 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 13174698?
The CAS number of BAS 13174698 is 874615-49-3.
What is the molecular formula of BAS 13174698?
The molecular formula of BAS 13174698 is C27H27N3O3.
What is the molecular weight of BAS 13174698?
The molecular weight of BAS 13174698 is 441.21 g/mol.
Where can I buy BAS 13174698?
You can request a quote for BAS 13174698 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13174698?
Yes, KEHONG BIO provides custom synthesis services for BAS 13174698 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.