![2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one structure](/static/products/1065/106511-87-9.webp)
2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
TL;DR: 2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one (CAS 106511-87-9) is a chemical compound with molecular formula C16H12N4OS and molecular weight 308.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Also Known As: 2-(3-methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one, 2-[(3-methylphenyl)amino]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one, 2-(m-toluidino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one, 2-(m-tolylamino)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one, 2-[(3-methylphenyl)amino]-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
| Molecular Formula | C16H12N4OS |
|---|---|
| Molecular Weight | 308.07 g/mol |
| LogP | 3.35622 |
| Topological Polar Surface Area | 59.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 308.07318 |
| Heavy Atoms | 22 |
| Complexity | 1050.8217 |
Chemical Identifiers
| CAS Number | 106511-87-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC2=NN3C(=O)C4=CC=CC=C4N=C3S2 |
Product Overview
2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one (CAS 106511-87-9), with molecular formula C16H12N4OS and molecular weight 308.07 g/mol. IUPAC: 2-(3-methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one.
Chemical Property Profile of 2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Property Insights of 2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
The XLogP value of 3.35622 indicates that 2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.29 Ų, 2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one has 1 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 2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one?
The CAS number of 2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one is 106511-87-9.
What is the molecular formula of 2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one?
The molecular formula of 2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one is C16H12N4OS.
What is the molecular weight of 2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one?
The molecular weight of 2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one is 308.07 g/mol.
Where can I buy 2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one?
You can request a quote for 2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Methylanilino)-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.