Propanethioamide, N,N-dimethyl-3-oxo-
TL;DR: Propanethioamide, N,N-dimethyl-3-oxo- (CAS 52022-76-1) is a chemical compound with molecular formula C5H9NOS and molecular weight 131.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-3-oxopropanethioamide
Also Known As: N,N-Dimethyl-3-oxopropanethioamide, Propanethioamide, N,N-dimethyl-3-oxo-, N,N-dimethyl -3-oxopropanethioamide, N,N-Dimethyl-3-oxopropanethioamide #
| Molecular Formula | C5H9NOS |
|---|---|
| Molecular Weight | 131.04 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 52.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 131.04048 |
| Heavy Atoms | 8 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 52022-76-1 |
|---|---|
| SMILES | CN(C)C(=S)CC=O |
| InChIKey | RHBDWQQNHABHIE-UHFFFAOYSA-N |
Product Overview
Propanethioamide, N,N-dimethyl-3-oxo- (CAS 52022-76-1), with molecular formula C5H9NOS and molecular weight 131.04 g/mol. IUPAC: N,N-dimethyl-3-oxopropanethioamide.
Chemical Property Profile of Propanethioamide, N,N-dimethyl-3-oxo-
Property Insights of Propanethioamide, N,N-dimethyl-3-oxo-
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanethioamide, N,N-dimethyl-3-oxo-. With a topological polar surface area (TPSA) of 52.4 Ų, Propanethioamide, N,N-dimethyl-3-oxo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanethioamide, N,N-dimethyl-3-oxo- has 0 hydrogen bond donor(s) and 2 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 Propanethioamide, N,N-dimethyl-3-oxo-?
The CAS number of Propanethioamide, N,N-dimethyl-3-oxo- is 52022-76-1.
What is the molecular formula of Propanethioamide, N,N-dimethyl-3-oxo-?
The molecular formula of Propanethioamide, N,N-dimethyl-3-oxo- is C5H9NOS.
What is the molecular weight of Propanethioamide, N,N-dimethyl-3-oxo-?
The molecular weight of Propanethioamide, N,N-dimethyl-3-oxo- is 131.04 g/mol.
Where can I buy Propanethioamide, N,N-dimethyl-3-oxo-?
You can request a quote for Propanethioamide, N,N-dimethyl-3-oxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanethioamide, N,N-dimethyl-3-oxo-?
Yes, KEHONG BIO provides custom synthesis services for Propanethioamide, N,N-dimethyl-3-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.