(5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one
TL;DR: (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one (CAS 329689-64-7) is a chemical compound with molecular formula C19H16N2O3S and molecular weight 352.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one
Also Known As: (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one, (5E)-3-ethyl-5-[(2Z)-2-(1-methylnaphtho[1,2-d][1,3]oxazol-2(1H)-ylidene)ethylidene]-2-thioxo-1,3-oxazolidin-4-one, (5E)-3-ETHYL-5-{2-[(2Z)-1-METHYL-1H,2H-NAPHTHO[1,2-D][1,3]OXAZOL-2-YLIDENE]ETHYLIDENE}-2-SULFANYLIDENE-1,3-OXAZOLIDIN-4-ONE, 3-ethyl-5-[2-(1-methylnaphtho[1,2-d][1,3]oxazol-2(1H)-ylidene)ethylidene]-2-thioxo-1,3-oxazolidin-4-one
| Molecular Formula | C19H16N2O3S |
|---|---|
| Molecular Weight | 352.09 g/mol |
| LogP | 3.5573 |
| Topological Polar Surface Area | 42.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 352.08817 |
| Heavy Atoms | 25 |
| Complexity | 964.2956 |
Chemical Identifiers
| CAS Number | 329689-64-7 |
|---|---|
| SMILES | CCN1C(=O)/C(=C\C=C/2\N(C3=C(O2)C=CC4=CC=CC=C43)C)/OC1=S |
Product Overview
(5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one (CAS 329689-64-7), with molecular formula C19H16N2O3S and molecular weight 352.09 g/mol. IUPAC: (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one.
Chemical Property Profile of (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one
Property Insights of (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one
The XLogP value of 3.5573 indicates that (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.01 Ų, (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one has 0 hydrogen bond donor(s) and 5 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 (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one?
The CAS number of (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one is 329689-64-7.
What is the molecular formula of (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one?
The molecular formula of (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one is C19H16N2O3S.
What is the molecular weight of (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one?
The molecular weight of (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one is 352.09 g/mol.
Where can I buy (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one?
You can request a quote for (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-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 (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (5E)-3-ethyl-5-[(2Z)-2-(1-methylbenzo[e][1,3]benzoxazol-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.