RefChem:230355
TL;DR: RefChem:230355 (CAS 67990-08-3) is a chemical compound with molecular formula C14H21N3OS and molecular weight 279.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-5-[2-(1-ethylpyrrolidin-2-ylidene)ethylidene]-3-methyl-2-sulfanylideneimidazolidin-4-one
Also Known As: 4-Imidazolidinone, 1-ethyl-5-[(1-ethyl-2-pyrrolidinylidene)ethylidene]-3-methyl-2-thioxo-, 1-ETHYL-5-[(1-ETHYL-2-PYRROLIDINYLIDENE)ETHYLIDENE]-3-METHYL-2-THIOXOIMIDAZOLIDIN-4-ONE, 1-Ethyl-5-(2-(1-ethyl-2-pyrrolidinylidene)ethylidene)-3-methyl-2-thiohydantoin, 1-Ethyl-5-(2-(1-ethyl-2-pyrrolidinylidene)ethylidene)-3-methyl-2-thioxo-4-imidazolidinone, 1-Ethyl-5-[2-(1-ethyl-2-pyrrolidinylidene)ethylidene]-3-methyl-2-thioxo-4-imidazolidinone
| Molecular Formula | C14H21N3OS |
|---|---|
| Molecular Weight | 279.14 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.14053 |
| Heavy Atoms | 19 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 67990-08-3 |
|---|---|
| SMILES | CCN1CCCC1=CC=C2C(=O)N(C(=S)N2CC)C |
| InChIKey | CIVNXUBWFVBYKC-UHFFFAOYSA-N |
Product Overview
RefChem:230355 (CAS 67990-08-3), with molecular formula C14H21N3OS and molecular weight 279.14 g/mol. IUPAC: 1-ethyl-5-[2-(1-ethylpyrrolidin-2-ylidene)ethylidene]-3-methyl-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of RefChem:230355
Property Insights of RefChem:230355
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:230355. With a topological polar surface area (TPSA) of 58.9 Ų, RefChem:230355 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:230355 has 0 hydrogen bond donor(s) and 3 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:230355?
The CAS number of RefChem:230355 is 67990-08-3.
What is the molecular formula of RefChem:230355?
The molecular formula of RefChem:230355 is C14H21N3OS.
What is the molecular weight of RefChem:230355?
The molecular weight of RefChem:230355 is 279.14 g/mol.
Where can I buy RefChem:230355?
You can request a quote for RefChem:230355 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:230355?
Yes, KEHONG BIO provides custom synthesis services for RefChem:230355 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.