CQQ8SQZ4TE
TL;DR: CQQ8SQZ4TE (CAS 866155-89-7) is a chemical compound with molecular formula C12H8F3N3O4S2 and molecular weight 378.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-[[3-(trifluoromethoxy)benzoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid
Also Known As: 2-[(5-{[3-(trifluoromethoxy)benzoyl]amino}-1,3,4-thiadiazol-2-yl)sulfanyl]acetic acid, 2-[[5-[[3-(trifluoromethoxy)benzoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetic Acid, 2-({5-[3-(trifluoromethoxy)benzamido]-1,3,4-thiadiazol-2-yl}sulfanyl)acetic acid, 2-((5-(3-(Trifluoromethoxy)benzamido)-1,3,4-thiadiazol-2-yl)thio)acetic acid, 2-[[5-[[3-(Trifluoromethoxy)benzoyl]amino]-1,3,4-thiadiazol-2-yl]thio]acetic acid
| Molecular Formula | C12H8F3N3O4S2 |
|---|---|
| Molecular Weight | 378.99 g/mol |
| LogP | 2.8657 |
| Topological Polar Surface Area | 101.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.99084 |
| Heavy Atoms | 24 |
| Complexity | 751.1445 |
Chemical Identifiers
| CAS Number | 866155-89-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC(F)(F)F)C(=O)NC2=NN=C(S2)SCC(=O)O |
Product Overview
CQQ8SQZ4TE (CAS 866155-89-7), with molecular formula C12H8F3N3O4S2 and molecular weight 378.99 g/mol. IUPAC: 2-[[5-[[3-(trifluoromethoxy)benzoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid.
Chemical Property Profile of CQQ8SQZ4TE
Property Insights of CQQ8SQZ4TE
The XLogP value of 2.8657 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CQQ8SQZ4TE. The TPSA of 101.41 Ų falls within the moderate polarity range, balancing permeability and solubility for CQQ8SQZ4TE. Following Lipinski's Rule of Five, CQQ8SQZ4TE has 2 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 CQQ8SQZ4TE?
The CAS number of CQQ8SQZ4TE is 866155-89-7.
What is the molecular formula of CQQ8SQZ4TE?
The molecular formula of CQQ8SQZ4TE is C12H8F3N3O4S2.
What is the molecular weight of CQQ8SQZ4TE?
The molecular weight of CQQ8SQZ4TE is 378.99 g/mol.
Where can I buy CQQ8SQZ4TE?
You can request a quote for CQQ8SQZ4TE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CQQ8SQZ4TE?
Yes, KEHONG BIO provides custom synthesis services for CQQ8SQZ4TE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.