EINECS 255-417-2
TL;DR: EINECS 255-417-2 (CAS 41504-26-1) is a chemical compound with molecular formula C12H16N2O2S and molecular weight 252.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-5-[2-(1-methylpyrrolidin-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one
Also Known As: EINECS 255-417-2, BAS 00009518, 3-ethyl-5-[2-(1-methylpyrrolidin-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one, 3-ETHYL-5-[(1-METHYL-2-PYRROLIDINYLIDENE)ETHYLIDENE]-2-THIOXOOXAZOLIDIN-4-ONE, 3-Ethyl-5-((1-methyl-2-pyrrolidinylidene)ethylidene)-2-thioxooxazolidin-4-one
| Molecular Formula | C12H16N2O2S |
|---|---|
| Molecular Weight | 252.09 g/mol |
| LogP | 1.6434 |
| Topological Polar Surface Area | 32.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.09325 |
| Heavy Atoms | 17 |
| Complexity | 414.7287 |
Chemical Identifiers
| CAS Number | 41504-26-1 |
|---|---|
| SMILES | CCN1C(=O)C(=CC=C2CCCN2C)OC1=S |
Product Overview
EINECS 255-417-2 (CAS 41504-26-1), with molecular formula C12H16N2O2S and molecular weight 252.09 g/mol. IUPAC: 3-ethyl-5-[2-(1-methylpyrrolidin-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one.
Chemical Property Profile of EINECS 255-417-2
Property Insights of EINECS 255-417-2
The XLogP value of 1.6434 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 255-417-2. With a topological polar surface area (TPSA) of 32.78 Ų, EINECS 255-417-2 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, EINECS 255-417-2 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 EINECS 255-417-2?
The CAS number of EINECS 255-417-2 is 41504-26-1.
What is the molecular formula of EINECS 255-417-2?
The molecular formula of EINECS 255-417-2 is C12H16N2O2S.
What is the molecular weight of EINECS 255-417-2?
The molecular weight of EINECS 255-417-2 is 252.09 g/mol.
Where can I buy EINECS 255-417-2?
You can request a quote for EINECS 255-417-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 255-417-2?
Yes, KEHONG BIO provides custom synthesis services for EINECS 255-417-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.