N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide
TL;DR: N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide (CAS 306731-97-5) 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-(3,5-dichlorophenyl)-2-morpholin-4-yl-2-sulfanylideneacetamide
Also Known As: N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide, AA-768/31452058, N-(3,5-dichlorophenyl)-2-(4-morpholinyl)-2-thioxoacetamide, N-(3,5-dichlorophenyl)-2-(morpholin-4-yl)-2-sulfanylideneacetamide, N-(3,5-dichlorophenyl)-2-morpholin-4-yl-2-sulfanylideneacetamide
| Molecular Formula | C12H12Cl2N2O2S |
|---|---|
| Molecular Weight | 318.00 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 73.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 317.99966 |
| Heavy Atoms | 19 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 306731-97-5 |
|---|---|
| SMILES | C1COCCN1C(=S)C(=O)NC2=CC(=CC(=C2)Cl)Cl |
| InChIKey | KHHSVIRPRKENLC-UHFFFAOYSA-N |
Product Overview
N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide (CAS 306731-97-5), with molecular formula C12H12Cl2N2O2S and molecular weight 318.00 g/mol. IUPAC: N-(3,5-dichlorophenyl)-2-morpholin-4-yl-2-sulfanylideneacetamide.
Chemical Property Profile of N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide
Property Insights of N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide. The TPSA of 73.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide. Following Lipinski's Rule of Five, N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide has 1 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-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide?
The CAS number of N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide is 306731-97-5.
What is the molecular formula of N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide?
The molecular formula of N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide is C12H12Cl2N2O2S.
What is the molecular weight of N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide?
The molecular weight of N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide is 318.00 g/mol.
Where can I buy N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide?
You can request a quote for N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3,5-dichlorophenyl)-2-morpholino-2-thioxoacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.