(Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one
TL;DR: (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one (CAS 429634-71-9) is a chemical compound with molecular formula C14H12N2O2S and molecular weight 272.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-methyl-5-[(4-prop-2-ynoxyphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one
Also Known As: AB00111027-01, (5Z)-3-METHYL-5-{[4-(PROP-2-YN-1-YLOXY)PHENYL]METHYLIDENE}-2-SULFANYLIDENEIMIDAZOLIDIN-4-ONE, (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one, F0920-3705, (5Z)-3-methyl-5-[(4-prop-2-ynoxyphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one
| Molecular Formula | C14H12N2O2S |
|---|---|
| Molecular Weight | 272.06 g/mol |
| LogP | 1.386 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.06195 |
| Heavy Atoms | 19 |
| Complexity | 584.4587 |
Chemical Identifiers
| CAS Number | 429634-71-9 |
|---|---|
| SMILES | CN1C(=O)/C(=C/C2=CC=C(C=C2)OCC#C)/NC1=S |
Product Overview
(Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one (CAS 429634-71-9), with molecular formula C14H12N2O2S and molecular weight 272.06 g/mol. IUPAC: (5Z)-3-methyl-5-[(4-prop-2-ynoxyphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one.
Chemical Property Profile of (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one
Property Insights of (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one
The XLogP value of 1.386 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one. With a topological polar surface area (TPSA) of 41.57 Ų, (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one has 1 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 (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one?
The CAS number of (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one is 429634-71-9.
What is the molecular formula of (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one?
The molecular formula of (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one is C14H12N2O2S.
What is the molecular weight of (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one?
The molecular weight of (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one is 272.06 g/mol.
Where can I buy (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one?
You can request a quote for (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-methyl-5-(4-(prop-2-yn-1-yloxy)benzylidene)-2-thioxoimidazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.