A3246/0137895
TL;DR: A3246/0137895 (CAS 1031247-39-8) is a chemical compound with molecular formula C29H30ClN3O3S and molecular weight 535.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-benzyl-3-[2-(4-chlorophenyl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide
Also Known As: A3246/0137895, 2-{1-benzyl-3-[2-(4-chlorophenyl)ethyl]-5-oxo-2-thioxoimidazolidin-4-yl}-N-(4-propoxyphenyl)acetamide, 2-(1-benzyl-3-(4-chlorophenethyl)-5-oxo-2-thioxoimidazolidin-4-yl)-N-(4-propoxyphenyl)acetamide, 2-[1-benzyl-3-[2-(4-chlorophenyl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide, 2-{1-BENZYL-3-[2-(4-CHLOROPHENYL)ETHYL]-5-OXO-2-SULFANYLIDENEIMIDAZOLIDIN-4-YL}-N-(4-PROPOXYPHENYL)ACETAMIDE
| Molecular Formula | C29H30ClN3O3S |
|---|---|
| Molecular Weight | 535.17 g/mol |
| LogP | 5.698 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 535.1696 |
| Heavy Atoms | 37 |
| Complexity | 1219.4089 |
Chemical Identifiers
| CAS Number | 1031247-39-8 |
|---|---|
| SMILES | CCCOC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCC3=CC=C(C=C3)Cl)CC4=CC=CC=C4 |
Product Overview
A3246/0137895 (CAS 1031247-39-8), with molecular formula C29H30ClN3O3S and molecular weight 535.17 g/mol. IUPAC: 2-[1-benzyl-3-[2-(4-chlorophenyl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide.
Chemical Property Profile of A3246/0137895
Property Insights of A3246/0137895
The XLogP value of 5.698 indicates that A3246/0137895 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for A3246/0137895. Following Lipinski's Rule of Five, A3246/0137895 has 1 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 A3246/0137895?
The CAS number of A3246/0137895 is 1031247-39-8.
What is the molecular formula of A3246/0137895?
The molecular formula of A3246/0137895 is C29H30ClN3O3S.
What is the molecular weight of A3246/0137895?
The molecular weight of A3246/0137895 is 535.17 g/mol.
Where can I buy A3246/0137895?
You can request a quote for A3246/0137895 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3246/0137895?
Yes, KEHONG BIO provides custom synthesis services for A3246/0137895 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.