N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide
TL;DR: N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide (CAS 462069-22-3) is a chemical compound with molecular formula C12H15NO3S and molecular weight 253.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide
Also Known As: N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide, BAS 05914190, N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-phenylacetamide, N-(1,1-Dioxo-tetrahydro-1lambda*6*-thiophen-3-yl)-2-phenyl-acetamide, N-(1,1-dioxo-1lambda-tetrahydro-3H-thien-3-yl)phenylacetamide
| Molecular Formula | C12H15NO3S |
|---|---|
| Molecular Weight | 253.08 g/mol |
| LogP | 0.5324 |
| Topological Polar Surface Area | 63.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.07727 |
| Heavy Atoms | 17 |
| Complexity | 495.74185 |
Chemical Identifiers
| CAS Number | 462069-22-3 |
|---|---|
| SMILES | C1CS(=O)(=O)CC1NC(=O)CC2=CC=CC=C2 |
Product Overview
N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide (CAS 462069-22-3), with molecular formula C12H15NO3S and molecular weight 253.08 g/mol. IUPAC: N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide.
Chemical Property Profile of N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide
Property Insights of N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide
The XLogP value of 0.5324 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide. The TPSA of 63.24 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide. Following Lipinski's Rule of Five, N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide 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-(1,1-dioxothiolan-3-yl)-2-phenylacetamide?
The CAS number of N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide is 462069-22-3.
What is the molecular formula of N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide?
The molecular formula of N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide is C12H15NO3S.
What is the molecular weight of N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide?
The molecular weight of N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide is 253.08 g/mol.
Where can I buy N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide?
You can request a quote for N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,1-dioxothiolan-3-yl)-2-phenylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.