RefChem:283777
TL;DR: RefChem:283777 (CAS 74796-95-5) is a chemical compound with molecular formula C26H24N6OS and molecular weight 468.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-methylanilino)methyl]-3-[5-[(2-methylanilino)methyl]-1,3,4-thiadiazol-2-yl]quinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 2-(((2-methylphenyl)amino)methyl)-3-(5-(((2-methylphenyl)amino)methyl)-1,3,4-thiadiazol-2-yl)-, 2-[(2-methylanilino)methyl]-3-[5-[(2-methylanilino)methyl]-1,3,4-thiadiazol-2-yl]quinazolin-4-one, 2-[(2-Methylanilino)methyl]-3-{5-[(2-methylanilino)methyl]-1,3,4-thiadiazol-2-yl}quinazolin-4(3H)-one, BRN 1058331, RefChem:283777
| Molecular Formula | C26H24N6OS |
|---|---|
| Molecular Weight | 468.17 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 468.17322 |
| Heavy Atoms | 34 |
| Complexity | 734.0 |
Chemical Identifiers
| CAS Number | 74796-95-5 |
|---|---|
| SMILES | CC1=CC=CC=C1NCC2=NC3=CC=CC=C3C(=O)N2C4=NN=C(S4)CNC5=CC=CC=C5C |
| InChIKey | LDUOGKYOKCIPNO-UHFFFAOYSA-N |
Product Overview
RefChem:283777 (CAS 74796-95-5), with molecular formula C26H24N6OS and molecular weight 468.17 g/mol. IUPAC: 2-[(2-methylanilino)methyl]-3-[5-[(2-methylanilino)methyl]-1,3,4-thiadiazol-2-yl]quinazolin-4-one.
Chemical Property Profile of RefChem:283777
Property Insights of RefChem:283777
The XLogP value of 5.2 indicates that RefChem:283777 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:283777. Following Lipinski's Rule of Five, RefChem:283777 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:283777?
The CAS number of RefChem:283777 is 74796-95-5.
What is the molecular formula of RefChem:283777?
The molecular formula of RefChem:283777 is C26H24N6OS.
What is the molecular weight of RefChem:283777?
The molecular weight of RefChem:283777 is 468.17 g/mol.
Where can I buy RefChem:283777?
You can request a quote for RefChem:283777 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:283777?
Yes, KEHONG BIO provides custom synthesis services for RefChem:283777 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.