RefChem:1071974
TL;DR: RefChem:1071974 (CAS 76834-43-0) is a chemical compound with molecular formula C14H12N4O2S and molecular weight 300.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(2-hydroxyphenyl)methylidene]-2-methyl-3-(5-methyl-1,3,4-thiadiazol-2-yl)imidazol-4-one
Also Known As: 4H-Imidazol-4-one, 3,5-dihydro-5-((2-hydroxyphenyl)methylene)-2-methyl-3-(5-methyl-1,3,4-thiadiazol-2-yl)-, 4H-IMIDAZOL-4-ONE, 3,5-DIHYDRO-5-((2-HYDROXYPHENYL)METHYLENE)-2-METHYL-3-(5-METH, (5Z)-5-[(2-hydroxyphenyl)methylidene]-2-methyl-3-(5-methyl-1,3,4-thiadiazol-2-yl)imidazol-4-one, RefChem:1071974
| Molecular Formula | C14H12N4O2S |
|---|---|
| Molecular Weight | 300.07 g/mol |
| LogP | 2.35822 |
| Topological Polar Surface Area | 78.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.06808 |
| Heavy Atoms | 21 |
| Complexity | 778.78613 |
Chemical Identifiers
| CAS Number | 76834-43-0 |
|---|---|
| SMILES | CC1=N/C(=C\C2=CC=CC=C2O)/C(=O)N1C3=NN=C(S3)C |
Product Overview
RefChem:1071974 (CAS 76834-43-0), with molecular formula C14H12N4O2S and molecular weight 300.07 g/mol. IUPAC: (5Z)-5-[(2-hydroxyphenyl)methylidene]-2-methyl-3-(5-methyl-1,3,4-thiadiazol-2-yl)imidazol-4-one.
Chemical Property Profile of RefChem:1071974
Property Insights of RefChem:1071974
The XLogP value of 2.35822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1071974. The TPSA of 78.68 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1071974. Following Lipinski's Rule of Five, RefChem:1071974 has 1 hydrogen bond donor(s) and 6 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:1071974?
The CAS number of RefChem:1071974 is 76834-43-0.
What is the molecular formula of RefChem:1071974?
The molecular formula of RefChem:1071974 is C14H12N4O2S.
What is the molecular weight of RefChem:1071974?
The molecular weight of RefChem:1071974 is 300.07 g/mol.
Where can I buy RefChem:1071974?
You can request a quote for RefChem:1071974 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1071974?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1071974 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.