A3101/0131312
TL;DR: A3101/0131312 (CAS 577983-35-8) is a chemical compound with molecular formula C26H24F3N3O4 and molecular weight 499.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(furan-2-ylmethyl)-6,6-dimethyl-3-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-3-(trifluoromethyl)-5,7-dihydroindole-2,4-dione
Also Known As: A3101/0131312, 1-(furan-2-ylmethyl)-6,6-dimethyl-3-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-3-(trifluoromethyl)-5,7-dihydroindole-2,4-dione, 1-(furan-2-ylmethyl)-6,6-dimethyl-3-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-(trifluoromethyl)-3,5,6,7-tetrahydro-1H-indole-2,4-dione, 1-(furan-2-ylmethyl)-6,6-dimethyl-3-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-(trifluoromethyl)-6,7-dihydro-1H-indole-2,4(3H,5H)-dione, 1-[(FURAN-2-YL)METHYL]-6,6-DIMETHYL-3-(5-METHYL-3-OXO-2-PHENYL-2,3-DIHYDRO-1H-PYRAZOL-4-YL)-3-(TRIFLUOROMETHYL)-2,3,4,5,6,7-HEXAHYDRO-1H-INDOLE-2,4-DIONE
| Molecular Formula | C26H24F3N3O4 |
|---|---|
| Molecular Weight | 499.17 g/mol |
| LogP | 4.55272 |
| Topological Polar Surface Area | 88.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 499.1719 |
| Heavy Atoms | 36 |
| Complexity | 1445.5853 |
Chemical Identifiers
| CAS Number | 577983-35-8 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=CC=CC=C2)C3(C4=C(CC(CC4=O)(C)C)N(C3=O)CC5=CC=CO5)C(F)(F)F |
Product Overview
A3101/0131312 (CAS 577983-35-8), with molecular formula C26H24F3N3O4 and molecular weight 499.17 g/mol. IUPAC: 1-(furan-2-ylmethyl)-6,6-dimethyl-3-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-3-(trifluoromethyl)-5,7-dihydroindole-2,4-dione.
Chemical Property Profile of A3101/0131312
Property Insights of A3101/0131312
The XLogP value of 4.55272 indicates that A3101/0131312 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.31 Ų falls within the moderate polarity range, balancing permeability and solubility for A3101/0131312. Following Lipinski's Rule of Five, A3101/0131312 has 1 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 A3101/0131312?
The CAS number of A3101/0131312 is 577983-35-8.
What is the molecular formula of A3101/0131312?
The molecular formula of A3101/0131312 is C26H24F3N3O4.
What is the molecular weight of A3101/0131312?
The molecular weight of A3101/0131312 is 499.17 g/mol.
Where can I buy A3101/0131312?
You can request a quote for A3101/0131312 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3101/0131312?
Yes, KEHONG BIO provides custom synthesis services for A3101/0131312 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.