A3240/0137617
TL;DR: A3240/0137617 (CAS 1042134-70-2) is a chemical compound with molecular formula C23H24FN3O4S and molecular weight 457.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-[3-[2-(4-fluorophenyl)ethyl]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetyl]amino]benzoate
Also Known As: A3240/0137617, ethyl 4-(2-(3-(4-fluorophenethyl)-1-methyl-5-oxo-2-thioxoimidazolidin-4-yl)acetamido)benzoate, ethyl 4-[({3-[2-(4-fluorophenyl)ethyl]-1-methyl-5-oxo-2-thioxoimidazolidin-4-yl}acetyl)amino]benzoate, ETHYL 4-(2-{3-[2-(4-FLUOROPHENYL)ETHYL]-1-METHYL-5-OXO-2-SULFANYLIDENEIMIDAZOLIDIN-4-YL}ACETAMIDO)BENZOATE, ethyl 4-(2-{3-[2-(4-fluorophenyl)ethyl]-1-methyl-5-oxo-2-thioxo-1,3-diazolidin -4-yl}acetylamino)benzoate
| Molecular Formula | C23H24FN3O4S |
|---|---|
| Molecular Weight | 457.15 g/mol |
| LogP | 3.0012 |
| Topological Polar Surface Area | 78.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 457.14716 |
| Heavy Atoms | 32 |
| Complexity | 1010.9065 |
Chemical Identifiers
| CAS Number | 1042134-70-2 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCC3=CC=C(C=C3)F)C |
Product Overview
A3240/0137617 (CAS 1042134-70-2), with molecular formula C23H24FN3O4S and molecular weight 457.15 g/mol. IUPAC: ethyl 4-[[2-[3-[2-(4-fluorophenyl)ethyl]-1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetyl]amino]benzoate.
Chemical Property Profile of A3240/0137617
Property Insights of A3240/0137617
The XLogP value of 3.0012 indicates that A3240/0137617 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.95 Ų falls within the moderate polarity range, balancing permeability and solubility for A3240/0137617. Following Lipinski's Rule of Five, A3240/0137617 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 A3240/0137617?
The CAS number of A3240/0137617 is 1042134-70-2.
What is the molecular formula of A3240/0137617?
The molecular formula of A3240/0137617 is C23H24FN3O4S.
What is the molecular weight of A3240/0137617?
The molecular weight of A3240/0137617 is 457.15 g/mol.
Where can I buy A3240/0137617?
You can request a quote for A3240/0137617 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3240/0137617?
Yes, KEHONG BIO provides custom synthesis services for A3240/0137617 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.