RefChem:284275
TL;DR: RefChem:284275 (CAS 135575-59-6) is a chemical compound with molecular formula C20H17BrClN5O2S2 and molecular weight 536.96954 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-bromo-3-[5-[3-(4-chloroanilino)-2-hydroxypropyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methylquinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 6-bromo-3-(5-((3-((4-chlorophenyl)amino)-2-hydroxypropyl)thio)1,3,4-thiadiazol-2-yl)-2-methyl-, 6-Bromo-2-methyl-3-[5-[[3-(4-chloroanilino)-2-hydroxypropyl]thio]-1,3,4-thiadiazol-2-yl]quinazolin-4(3H)-one, 6-Bromo-3-(5-{[3-(4-chloroanilino)-2-hydroxypropyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylquinazolin-4(3H)-one, 6-bromo-3-[5-({3-[(4-chlorophenyl)amino]-2-hydroxypropyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-2-methyl-3,4-dihydroquinazolin-4-one, 6-bromo-3-[5-({3-[(4-chlorophenyl)amino]-2-hydroxypropyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-2-methylquinazolin-4(3h)-one
Technical Specifications
| Molecular Formula | C20H17BrClN5O2S2 |
| Molecular Weight | 536.96954 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 144.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 536.96954 Da |
| Heavy Atoms | 31 |
| Complexity | 669.0 |
| SMILES | CC1=NC2=C(C=C(C=C2)Br)C(=O)N1C3=NN=C(S3)SCC(CNC4=CC=C(C=C4)Cl)O |
| InChIKey | OTUPAADDYDGMPJ-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:284275
Property Insights of RefChem:284275
The XLogP value of 4.4 indicates that RefChem:284275 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.0 Ų indicates high polarity, suggesting RefChem:284275 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:284275 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:284275?
The CAS number of RefChem:284275 is 135575-59-6.
What is the molecular formula of RefChem:284275?
The molecular formula of RefChem:284275 is C20H17BrClN5O2S2.
What is the molecular weight of RefChem:284275?
The molecular weight of RefChem:284275 is 536.96954 g/mol.
Where can I buy RefChem:284275?
You can request a quote for RefChem:284275 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:284275?
Yes, CoreyChem provides custom synthesis services for RefChem:284275 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.