4G-917
TL;DR: 4G-917 (CAS 318239-71-3) is a chemical compound with molecular formula C29H25F3N2O5 and molecular weight 538.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-benzyl-1-(4-methoxyphenyl)-4,6-dioxo-5-[3-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylate
Also Known As: 4G-917, methyl 1-benzyl-3-(4-methoxyphenyl)-4,6-dioxo-5-[3-(trifluoromethyl)phenyl]octahydropyrrolo[3,4-c]pyrrole-1-carboxylate, methyl 3-benzyl-1-(4-methoxyphenyl)-4,6-dioxo-5-[3-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylate, methyl 1-benzyl-3-(4-methoxyphenyl)-4,6-dioxo-5-[3-(trifluoromethyl)phenyl]-octahydropyrrolo[3,4-c]pyrrole-1-carboxylate, methyl 1-benzyl-3-(4-methoxyphenyl)-4,6-dioxo-5-[3-(trifluoromethyl)phenyl]-tetrahydropyrrolo[3,4-c]pyrrole-1-carboxylate
| Molecular Formula | C29H25F3N2O5 |
|---|---|
| Molecular Weight | 538.17 g/mol |
| LogP | 4.3186 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 538.1716 |
| Heavy Atoms | 39 |
| Complexity | 1410.4254 |
Chemical Identifiers
| CAS Number | 318239-71-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2C3C(C(=O)N(C3=O)C4=CC=CC(=C4)C(F)(F)F)C(N2)(CC5=CC=CC=C5)C(=O)OC |
Product Overview
4G-917 (CAS 318239-71-3), with molecular formula C29H25F3N2O5 and molecular weight 538.17 g/mol. IUPAC: methyl 3-benzyl-1-(4-methoxyphenyl)-4,6-dioxo-5-[3-(trifluoromethyl)phenyl]-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylate.
Chemical Property Profile of 4G-917
Property Insights of 4G-917
The XLogP value of 4.3186 indicates that 4G-917 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 4G-917. Following Lipinski's Rule of Five, 4G-917 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4G-917?
The CAS number of 4G-917 is 318239-71-3.
What is the molecular formula of 4G-917?
The molecular formula of 4G-917 is C29H25F3N2O5.
What is the molecular weight of 4G-917?
The molecular weight of 4G-917 is 538.17 g/mol.
Where can I buy 4G-917?
You can request a quote for 4G-917 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4G-917?
Yes, KEHONG BIO provides custom synthesis services for 4G-917 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.