RefChem:233384
TL;DR: RefChem:233384 (CAS 29140-80-5) is a chemical compound with molecular formula C17H32N4O4S2 and molecular weight 420.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-ethoxy-2-oxoethyl)piperazine-1-carbodithioic acid;ethyl 2-piperazin-1-ylacetate
Also Known As: 4-(Dithiocarboxy)-1-piperazineacetic acid 1-ethyl ester compd. with ethyl 1-piperazineacetate, 1-Piperazineacetic acid, 4-(dithiocarboxy)-, 1-ethyl ester, compd. with ethyl 1-piperazineacetate (1:1), 4-(2-ethoxy-2-oxoethyl)piperazine-1-carbodithioic acid; ethyl 2-piperazin-1-ylacetate, 4-(2-Ethoxy-2-oxoethyl)piperazine-1-carbodithioic acid--ethyl (piperazin-1-yl)acetate (1/1), RefChem:233384
| Molecular Formula | C17H32N4O4S2 |
|---|---|
| Molecular Weight | 420.19 g/mol |
| LogP | -0.1635 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 420.1865 |
| Heavy Atoms | 27 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 29140-80-5 |
|---|---|
| SMILES | CCOC(=O)CN1CCNCC1.CCOC(=O)CN1CCN(CC1)C(=S)S |
| InChIKey | DADXTLAWWNOUPG-UHFFFAOYSA-N |
Product Overview
RefChem:233384 (CAS 29140-80-5), with molecular formula C17H32N4O4S2 and molecular weight 420.19 g/mol. IUPAC: 4-(2-ethoxy-2-oxoethyl)piperazine-1-carbodithioic acid;ethyl 2-piperazin-1-ylacetate.
Chemical Property Profile of RefChem:233384
Property Insights of RefChem:233384
The XLogP value of -0.1635 indicates that RefChem:233384 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:233384. Following Lipinski's Rule of Five, RefChem:233384 has 2 hydrogen bond donor(s) and 9 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 RefChem:233384?
The CAS number of RefChem:233384 is 29140-80-5.
What is the molecular formula of RefChem:233384?
The molecular formula of RefChem:233384 is C17H32N4O4S2.
What is the molecular weight of RefChem:233384?
The molecular weight of RefChem:233384 is 420.19 g/mol.
Where can I buy RefChem:233384?
You can request a quote for RefChem:233384 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:233384?
Yes, KEHONG BIO provides custom synthesis services for RefChem:233384 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.