RefChem:284273
TL;DR: RefChem:284273 (CAS 135575-56-3) is a chemical compound with molecular formula C20H18BrN5O2S2 and molecular weight 503.00854 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[5-(3-anilino-2-hydroxypropyl)sulfanyl-1,3,4-thiadiazol-2-yl]-6-bromo-2-methylquinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 6-bromo-3-(5-((2-hydroxy-3-(phenylamino)propyl)thio)-1,3,4-thiadiazol-2-yl)-2-methyl-, 3-[5-(3-anilino-2-hydroxypropyl)sulfanyl-1,3,4-thiadiazol-2-yl]-6-bromo-2-methylquinazolin-4-one, 3-{5-[(3-Anilino-2-hydroxypropyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-6-bromo-2-methylquinazolin-4(3H)-one, 6-Bromo-2-methyl-3-[5-[[3-anilino-2-hydroxypropyl]thio]-1,3,4-thiadiazol-2-yl]quinazolin-4(3H)-one, 6-bromo-3-(5-{[2-hydroxy-3-(phenylamino)propyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methyl-3,4-dihydroquinazolin-4-one
Technical Specifications
| Molecular Formula | C20H18BrN5O2S2 |
| Molecular Weight | 503.00854 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 144.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 503.00854 Da |
| Heavy Atoms | 30 |
| Complexity | 636.0 |
| SMILES | CC1=NC2=C(C=C(C=C2)Br)C(=O)N1C3=NN=C(S3)SCC(CNC4=CC=CC=C4)O |
| InChIKey | QFYHNGHPLYDHCR-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:284273
Property Insights of RefChem:284273
The XLogP value of 3.8 indicates that RefChem:284273 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.0 Ų indicates high polarity, suggesting RefChem:284273 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:284273 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:284273?
The CAS number of RefChem:284273 is 135575-56-3.
What is the molecular formula of RefChem:284273?
The molecular formula of RefChem:284273 is C20H18BrN5O2S2.
What is the molecular weight of RefChem:284273?
The molecular weight of RefChem:284273 is 503.00854 g/mol.
Where can I buy RefChem:284273?
You can request a quote for RefChem:284273 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:284273?
Yes, CoreyChem provides custom synthesis services for RefChem:284273 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.