AN-584/43292775
TL;DR: AN-584/43292775 (CAS 885115-90-2) is a chemical compound with molecular formula C12H12F3NO3S and molecular weight 307.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,2,2-trifluoroacetyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylic acid
Also Known As: AN-584/43292775, 2-[(trifluoroacetyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylic acid, 2-(trifluoroacetamido)-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxylic acid, 2-[(2,2,2-trifluoroacetyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylic acid, 2-(2,2,2-trifluoroacetamido)-5,6,7,8-tetrahydro-4h-cyclohepta[b]thiophene-3-carboxylic acid
| Molecular Formula | C12H12F3NO3S |
|---|---|
| Molecular Weight | 307.05 g/mol |
| LogP | 3.216 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.049 |
| Heavy Atoms | 20 |
| Complexity | 550.8778 |
Chemical Identifiers
| CAS Number | 885115-90-2 |
|---|---|
| SMILES | C1CCC2=C(CC1)SC(=C2C(=O)O)NC(=O)C(F)(F)F |
Product Overview
AN-584/43292775 (CAS 885115-90-2), with molecular formula C12H12F3NO3S and molecular weight 307.05 g/mol. IUPAC: 2-[(2,2,2-trifluoroacetyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylic acid.
Chemical Property Profile of AN-584/43292775
Property Insights of AN-584/43292775
The XLogP value of 3.216 indicates that AN-584/43292775 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-584/43292775. Following Lipinski's Rule of Five, AN-584/43292775 has 2 hydrogen bond donor(s) and 3 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 AN-584/43292775?
The CAS number of AN-584/43292775 is 885115-90-2.
What is the molecular formula of AN-584/43292775?
The molecular formula of AN-584/43292775 is C12H12F3NO3S.
What is the molecular weight of AN-584/43292775?
The molecular weight of AN-584/43292775 is 307.05 g/mol.
Where can I buy AN-584/43292775?
You can request a quote for AN-584/43292775 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-584/43292775?
Yes, KEHONG BIO provides custom synthesis services for AN-584/43292775 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.