(5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
TL;DR: (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one (CAS 950862-23-4) is a chemical compound with molecular formula C9H7N3OS and molecular weight 205.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanylideneimidazolidin-4-one
Also Known As: BAS 00262476, (Z)-5-(pyridin-4-ylmethylene)-2-thioxoimidazolidin-4-one, (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanylideneimidazolidin-4-one, (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
| Molecular Formula | C9H7N3OS |
|---|---|
| Molecular Weight | 205.03 g/mol |
| LogP | 0.4268 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 205.03099 |
| Heavy Atoms | 14 |
| Complexity | 413.32507 |
Chemical Identifiers
| CAS Number | 950862-23-4 |
|---|---|
| SMILES | C1=CN=CC=C1/C=C\2/C(=O)NC(=S)N2 |
Product Overview
(5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one (CAS 950862-23-4), with molecular formula C9H7N3OS and molecular weight 205.03 g/mol. IUPAC: (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
Property Insights of (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one
The XLogP value of 0.4268 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one. With a topological polar surface area (TPSA) of 54.02 Ų, (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one has 2 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 (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one?
The CAS number of (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one is 950862-23-4.
What is the molecular formula of (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one?
The molecular formula of (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one is C9H7N3OS.
What is the molecular weight of (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one?
The molecular weight of (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one is 205.03 g/mol.
Where can I buy (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one?
You can request a quote for (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-5-(pyridin-4-ylmethylidene)-2-sulfanyl-3,5-dihydro-4H-imidazol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.