AB01304287-01
TL;DR: AB01304287-01 (CAS 727664-50-8) is a chemical compound with molecular formula C21H16F3NO3S and molecular weight 419.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methylsulfanylphenyl)-1-[3-(trifluoromethyl)phenyl]-4,7-dihydro-3H-furo[3,4-b]pyridine-2,5-dione
Also Known As: AB01304287-01, A3736/0158338, 4-(4-methylsulfanylphenyl)-1-[3-(trifluoromethyl)phenyl]-4,7-dihydro-3H-furo[3,4-b]pyridine-2,5-dione, 4-[4-(methylsulfanyl)phenyl]-1-[3-(trifluoromethyl)phenyl]-4,7-dihydrofuro[3,4-b]pyridine-2,5(1H,3H)-dione, 4-(4-(methylthio)phenyl)-1-(3-(trifluoromethyl)phenyl)-3,4-dihydrofuro[3,4-b]pyridine-2,5(1H,7H)-dione
| Molecular Formula | C21H16F3NO3S |
|---|---|
| Molecular Weight | 419.08 g/mol |
| LogP | 4.7587 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 419.0803 |
| Heavy Atoms | 29 |
| Complexity | 1014.57654 |
Chemical Identifiers
| CAS Number | 727664-50-8 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)C2CC(=O)N(C3=C2C(=O)OC3)C4=CC=CC(=C4)C(F)(F)F |
Product Overview
AB01304287-01 (CAS 727664-50-8), with molecular formula C21H16F3NO3S and molecular weight 419.08 g/mol. IUPAC: 4-(4-methylsulfanylphenyl)-1-[3-(trifluoromethyl)phenyl]-4,7-dihydro-3H-furo[3,4-b]pyridine-2,5-dione.
Chemical Property Profile of AB01304287-01
Property Insights of AB01304287-01
The XLogP value of 4.7587 indicates that AB01304287-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.61 Ų, AB01304287-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB01304287-01 has 0 hydrogen bond donor(s) and 4 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 AB01304287-01?
The CAS number of AB01304287-01 is 727664-50-8.
What is the molecular formula of AB01304287-01?
The molecular formula of AB01304287-01 is C21H16F3NO3S.
What is the molecular weight of AB01304287-01?
The molecular weight of AB01304287-01 is 419.08 g/mol.
Where can I buy AB01304287-01?
You can request a quote for AB01304287-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01304287-01?
Yes, KEHONG BIO provides custom synthesis services for AB01304287-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.