![1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea structure](/static/products/5212/52121-08-1.webp)
1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea
TL;DR: 1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea (CAS 52121-08-1) is a chemical compound with molecular formula C13H19N5O4S and molecular weight 341.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea
Also Known As: (3E)-1-ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-, (3E)-1-ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea, 1-ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea
| Molecular Formula | C13H19N5O4S |
|---|---|
| Molecular Weight | 341.12 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 341.11578 |
| Heavy Atoms | 23 |
| Complexity | 551.0 |
Chemical Identifiers
| CAS Number | 52121-08-1 |
|---|---|
| SMILES | CCNC(=O)N=C1N(C=C(S1)[N+](=O)[O-])CC(=O)N2CCCCC2 |
| InChIKey | BXKYHHPKFGBJOT-UHFFFAOYSA-N |
Product Overview
1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea (CAS 52121-08-1), with molecular formula C13H19N5O4S and molecular weight 341.12 g/mol. IUPAC: 1-ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea.
Chemical Property Profile of 1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea
Property Insights of 1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea. Following Lipinski's Rule of Five, 1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea has 1 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 1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea?
The CAS number of 1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea is 52121-08-1.
What is the molecular formula of 1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea?
The molecular formula of 1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea is C13H19N5O4S.
What is the molecular weight of 1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea?
The molecular weight of 1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea is 341.12 g/mol.
Where can I buy 1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea?
You can request a quote for 1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl-3-[5-nitro-3-(2-oxo-2-piperidin-1-ylethyl)-1,3-thiazol-2-ylidene]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.