N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide
TL;DR: N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide (CAS 876667-80-0) is a chemical compound with molecular formula C12H12Cl2N2O2S and molecular weight 318.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide
Also Known As: N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide, BAS 12534396, N-(2,3-Dichloro-phenyl)-2-(3-oxo-thiomorpholin-2-yl)-acetamide, N-(2,3-dichlorophenyl)-2-(3-oxo(1,4-thiazaperhydroin-2-yl))acetamide
| Molecular Formula | C12H12Cl2N2O2S |
|---|---|
| Molecular Weight | 318.00 g/mol |
| LogP | 2.5536 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 317.99966 |
| Heavy Atoms | 19 |
| Complexity | 510.50278 |
Chemical Identifiers
| CAS Number | 876667-80-0 |
|---|---|
| SMILES | C1CSC(C(=O)N1)CC(=O)NC2=C(C(=CC=C2)Cl)Cl |
Product Overview
N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide (CAS 876667-80-0), with molecular formula C12H12Cl2N2O2S and molecular weight 318.00 g/mol. IUPAC: N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide.
Chemical Property Profile of N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide
Property Insights of N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide
The XLogP value of 2.5536 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide. With a topological polar surface area (TPSA) of 58.2 Ų, N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide has 2 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 N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide?
The CAS number of N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide is 876667-80-0.
What is the molecular formula of N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide?
The molecular formula of N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide is C12H12Cl2N2O2S.
What is the molecular weight of N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide?
The molecular weight of N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide is 318.00 g/mol.
Where can I buy N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide?
You can request a quote for N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,3-dichlorophenyl)-2-(3-oxothiomorpholin-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.