RefChem:1071917
TL;DR: RefChem:1071917 (CAS 100037-22-7) is a chemical compound with molecular formula C19H14N4OS and molecular weight 346.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-benzylidene-2-methyl-3-(5-phenyl-1,3,4-thiadiazol-2-yl)imidazol-4-one
Also Known As: 4-Benzylidene-2-methyl-1-(5-phenyl-1,3,4-thiadiazol-2-yl)-2-imidazolin-5-one, 4H-Imidazol-4-one, 3,5-dihydro-2-methyl-5-(phenylmethylene)-3-(5-phenyl-1,3,4-thiadiazol-2-yl)-, 2-Imidazolin-5-one, 4-benzylidene-2-methyl-1-(5-phenyl-1,3,4-thiadiazol-2-yl)-, (5Z)-5-benzylidene-2-methyl-3-(5-phenyl-1,3,4-thiadiazol-2-yl)imidazol-4-one, 4H-IMIDAZOL-4-ONE, 3,5-DIHYDRO-2-METHYL-5-(PHENYLMETHYLENE)-3-(5-PHENYL-1,3,4-TH
| Molecular Formula | C19H14N4OS |
|---|---|
| Molecular Weight | 346.09 g/mol |
| LogP | 4.0112 |
| Topological Polar Surface Area | 58.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.08884 |
| Heavy Atoms | 25 |
| Complexity | 976.9283 |
Chemical Identifiers
| CAS Number | 100037-22-7 |
|---|---|
| SMILES | CC1=N/C(=C\C2=CC=CC=C2)/C(=O)N1C3=NN=C(S3)C4=CC=CC=C4 |
Product Overview
RefChem:1071917 (CAS 100037-22-7), with molecular formula C19H14N4OS and molecular weight 346.09 g/mol. IUPAC: (5Z)-5-benzylidene-2-methyl-3-(5-phenyl-1,3,4-thiadiazol-2-yl)imidazol-4-one.
Chemical Property Profile of RefChem:1071917
Property Insights of RefChem:1071917
The XLogP value of 4.0112 indicates that RefChem:1071917 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.45 Ų, RefChem:1071917 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1071917 has 0 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 RefChem:1071917?
The CAS number of RefChem:1071917 is 100037-22-7.
What is the molecular formula of RefChem:1071917?
The molecular formula of RefChem:1071917 is C19H14N4OS.
What is the molecular weight of RefChem:1071917?
The molecular weight of RefChem:1071917 is 346.09 g/mol.
Where can I buy RefChem:1071917?
You can request a quote for RefChem:1071917 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1071917?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1071917 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.