3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one
TL;DR: 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one (CAS 1164520-73-3) is a chemical compound with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-ethyl-5-(1-methyl-2-pyridinylidene)-2-sulfanylidene-1,3-oxazolidin-4-one
Also Known As: BAS 00524995, 3-ETHYL-5- -4-OXO-2-THIOXO-OXAZOLE, 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one, (E)-3-ethyl-5-(1-methylpyridin-2(1H)-ylidene)-2-thioxooxazolidin-4-one, (5E)-3-ethyl-5-(1-methylpyridin-2(1H)-ylidene)-2-thioxo-1,3-oxazolidin-4-one
| Molecular Formula | C11H12N2O2S |
|---|---|
| Molecular Weight | 236.06 g/mol |
| LogP | 1.3769 |
| Topological Polar Surface Area | 32.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.06195 |
| Heavy Atoms | 16 |
| Complexity | 437.2655 |
Chemical Identifiers
| CAS Number | 1164520-73-3 |
|---|---|
| SMILES | CCN1C(=O)/C(=C\2/C=CC=CN2C)/OC1=S |
Product Overview
3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one (CAS 1164520-73-3), with molecular formula C11H12N2O2S and molecular weight 236.06 g/mol. IUPAC: (5E)-3-ethyl-5-(1-methyl-2-pyridinylidene)-2-sulfanylidene-1,3-oxazolidin-4-one.
Chemical Property Profile of 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one
Property Insights of 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one
The XLogP value of 1.3769 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one. With a topological polar surface area (TPSA) of 32.78 Ų, 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one has 0 hydrogen bond donor(s) and 4 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 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one?
The CAS number of 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one is 1164520-73-3.
What is the molecular formula of 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one?
The molecular formula of 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one is C11H12N2O2S.
What is the molecular weight of 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one?
The molecular weight of 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one is 236.06 g/mol.
Where can I buy 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one?
You can request a quote for 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethyl-5-(1-methyl-1H-pyridin-2-ylidene)-2-thioxo-oxazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.