A3246/0137885
TL;DR: A3246/0137885 (CAS 1023911-86-5) is a chemical compound with molecular formula C26H22FN3O4S and molecular weight 491.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-fluorophenyl)acetamide
Also Known As: A3246/0137885, 2-[3-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-fluorophenyl)acetamide, 2-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-1-benzyl-5-oxo-2-thioxoimidazolidin-4-yl)-N-(4-fluorophenyl)acetamide, 2-[3-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-5-oxo-2-thioxoimidazolidin-4-yl]-N-(4-fluorophenyl)acetamide, 2-{3-[(2H-1,3-BENZODIOXOL-5-YL)METHYL]-1-BENZYL-5-OXO-2-SULFANYLIDENEIMIDAZOLIDIN-4-YL}-N-(4-FLUOROPHENYL)ACETAMIDE
| Molecular Formula | C26H22FN3O4S |
|---|---|
| Molecular Weight | 491.13 g/mol |
| LogP | 4.0811 |
| Topological Polar Surface Area | 71.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 491.1315 |
| Heavy Atoms | 35 |
| Complexity | 1269.3484 |
Chemical Identifiers
| CAS Number | 1023911-86-5 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CN3C(C(=O)N(C3=S)CC4=CC=CC=C4)CC(=O)NC5=CC=C(C=C5)F |
Product Overview
A3246/0137885 (CAS 1023911-86-5), with molecular formula C26H22FN3O4S and molecular weight 491.13 g/mol. IUPAC: 2-[3-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-fluorophenyl)acetamide.
Chemical Property Profile of A3246/0137885
Property Insights of A3246/0137885
The XLogP value of 4.0811 indicates that A3246/0137885 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.11 Ų falls within the moderate polarity range, balancing permeability and solubility for A3246/0137885. Following Lipinski's Rule of Five, A3246/0137885 has 1 hydrogen bond donor(s) and 5 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 A3246/0137885?
The CAS number of A3246/0137885 is 1023911-86-5.
What is the molecular formula of A3246/0137885?
The molecular formula of A3246/0137885 is C26H22FN3O4S.
What is the molecular weight of A3246/0137885?
The molecular weight of A3246/0137885 is 491.13 g/mol.
Where can I buy A3246/0137885?
You can request a quote for A3246/0137885 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3246/0137885?
Yes, KEHONG BIO provides custom synthesis services for A3246/0137885 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.