4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one
TL;DR: 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one (CAS 160922-82-7) is a chemical compound with molecular formula C20H17N3O3S and molecular weight 379.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-6-[[5-(4-methylanilino)-1,3,4-thiadiazol-2-yl]methoxy]chromen-2-one
Also Known As: AQ-150/42303585, 4-methyl-6-[[5-(4-methylanilino)-1,3,4-thiadiazol-2-yl]methoxy]chromen-2-one, 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one, 4-Methyl-6-((5-(p-tolylamino)-1,3,4-thiadiazol-2-yl)methoxy)-2H-chromen-2-one, 4-methyl-6-[[5-[(4-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]methoxy]chromen-2-one
| Molecular Formula | C20H17N3O3S |
|---|---|
| Molecular Weight | 379.10 g/mol |
| LogP | 4.58394 |
| Topological Polar Surface Area | 77.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 379.09906 |
| Heavy Atoms | 27 |
| Complexity | 1149.3159 |
Chemical Identifiers
| CAS Number | 160922-82-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC2=NN=C(S2)COC3=CC4=C(C=C3)OC(=O)C=C4C |
Product Overview
4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one (CAS 160922-82-7), with molecular formula C20H17N3O3S and molecular weight 379.10 g/mol. IUPAC: 4-methyl-6-[[5-(4-methylanilino)-1,3,4-thiadiazol-2-yl]methoxy]chromen-2-one.
Chemical Property Profile of 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one
Property Insights of 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one
The XLogP value of 4.58394 indicates that 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.25 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one. Following Lipinski's Rule of Five, 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one has 1 hydrogen bond donor(s) and 7 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 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one?
The CAS number of 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one is 160922-82-7.
What is the molecular formula of 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one?
The molecular formula of 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one is C20H17N3O3S.
What is the molecular weight of 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one?
The molecular weight of 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one is 379.10 g/mol.
Where can I buy 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one?
You can request a quote for 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-6-{[5-(4-toluidino)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.