A3281/0139594
TL;DR: A3281/0139594 (CAS 577765-85-6) is a chemical compound with molecular formula C27H27F3N2O4 and molecular weight 500.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[6,6-dimethyl-2,4-dioxo-1-(2-phenylethyl)-3-(trifluoromethyl)-5,7-dihydroindol-3-yl]-4-methoxybenzamide
Also Known As: A3281/0139594, N-[6,6-dimethyl-2,4-dioxo-1-(2-phenylethyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-4-methoxybenzamide, N-(6,6-dimethyl-2,4-dioxo-1-phenethyl-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-4-methoxybenzamide, N-[6,6-dimethyl-2,4-dioxo-1-phenethyl-3-(trifluoromethyl)-5,7-dihydroindol-3-yl]-4-methoxybenzamide
| Molecular Formula | C27H27F3N2O4 |
|---|---|
| Molecular Weight | 500.19 g/mol |
| LogP | 4.4542 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 500.1923 |
| Heavy Atoms | 36 |
| Complexity | 1219.83 |
Chemical Identifiers
| CAS Number | 577765-85-6 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)C(C(=O)N2CCC3=CC=CC=C3)(C(F)(F)F)NC(=O)C4=CC=C(C=C4)OC)C |
Product Overview
A3281/0139594 (CAS 577765-85-6), with molecular formula C27H27F3N2O4 and molecular weight 500.19 g/mol. IUPAC: N-[6,6-dimethyl-2,4-dioxo-1-(2-phenylethyl)-3-(trifluoromethyl)-5,7-dihydroindol-3-yl]-4-methoxybenzamide.
Chemical Property Profile of A3281/0139594
Property Insights of A3281/0139594
The XLogP value of 4.4542 indicates that A3281/0139594 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for A3281/0139594. Following Lipinski's Rule of Five, A3281/0139594 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3281/0139594?
The CAS number of A3281/0139594 is 577765-85-6.
What is the molecular formula of A3281/0139594?
The molecular formula of A3281/0139594 is C27H27F3N2O4.
What is the molecular weight of A3281/0139594?
The molecular weight of A3281/0139594 is 500.19 g/mol.
Where can I buy A3281/0139594?
You can request a quote for A3281/0139594 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3281/0139594?
Yes, KEHONG BIO provides custom synthesis services for A3281/0139594 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.