2-Amino-2-thioxoethyl 2,2-dimethylpropanoate
TL;DR: 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate (CAS 175204-79-2) is a chemical compound with molecular formula C7H13NO2S and molecular weight 175.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-amino-2-sulfanylideneethyl) 2,2-dimethylpropanoate
Also Known As: 2-Amino-2-thioxoethyl pivalate, Maybridge1_006303, 2-Amino-2-thioxoethylpivalate, 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate, 2-(pivaloyloxy)-thioacetamide
| Molecular Formula | C7H13NO2S |
|---|---|
| Molecular Weight | 175.07 g/mol |
| LogP | 0.8618 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 175.0667 |
| Heavy Atoms | 11 |
| Complexity | 171.7696 |
Chemical Identifiers
| CAS Number | 175204-79-2 |
|---|---|
| SMILES | CC(C)(C)C(=O)OCC(=S)N |
Product Overview
2-Amino-2-thioxoethyl 2,2-dimethylpropanoate (CAS 175204-79-2), with molecular formula C7H13NO2S and molecular weight 175.07 g/mol. IUPAC: (2-amino-2-sulfanylideneethyl) 2,2-dimethylpropanoate.
Chemical Property Profile of 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate
Property Insights of 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate
The XLogP value of 0.8618 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate. With a topological polar surface area (TPSA) of 52.32 Ų, 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate 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 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate?
The CAS number of 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate is 175204-79-2.
What is the molecular formula of 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate?
The molecular formula of 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate is C7H13NO2S.
What is the molecular weight of 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate?
The molecular weight of 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate is 175.07 g/mol.
Where can I buy 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate?
You can request a quote for 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-2-thioxoethyl 2,2-dimethylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.