4G-910
TL;DR: 4G-910 (CAS 338420-24-9) is a chemical compound with molecular formula C16H13F3N2O7 and molecular weight 402.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 4,6-dioxo-5-[3-(trifluoromethyl)phenyl]-3a,6a-dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-3,3-dicarboxylate
Also Known As: 4G-910, dimethyl 4,6-dioxo-5-[3-(trifluoromethyl)phenyl]tetrahydro-2H-pyrrolo[3,4-d]isoxazole-3,3(3aH)-dicarboxylate, dimethyl 4,6-dioxo-5-[3-(trifluoromethyl)phenyl]-3a,6a-dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-3,3-dicarboxylate, 3,3-dimethyl 4,6-dioxo-5-[3-(trifluoromethyl)phenyl]-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-3,3-dicarboxylate, 3,3-dimethyl4,6-dioxo-5-[3-(trifluoromethyl)phenyl]-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-3,3-dicarboxylate
| Molecular Formula | C16H13F3N2O7 |
|---|---|
| Molecular Weight | 402.07 g/mol |
| LogP | 0.183 |
| Topological Polar Surface Area | 111.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 402.06747 |
| Heavy Atoms | 28 |
| Complexity | 854.039 |
Chemical Identifiers
| CAS Number | 338420-24-9 |
|---|---|
| SMILES | COC(=O)C1(C2C(C(=O)N(C2=O)C3=CC=CC(=C3)C(F)(F)F)ON1)C(=O)OC |
Product Overview
4G-910 (CAS 338420-24-9), with molecular formula C16H13F3N2O7 and molecular weight 402.07 g/mol. IUPAC: dimethyl 4,6-dioxo-5-[3-(trifluoromethyl)phenyl]-3a,6a-dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-3,3-dicarboxylate.
Chemical Property Profile of 4G-910
Property Insights of 4G-910
The XLogP value of 0.183 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4G-910. The TPSA of 111.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 4G-910. Following Lipinski's Rule of Five, 4G-910 has 1 hydrogen bond donor(s) and 8 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 4G-910?
The CAS number of 4G-910 is 338420-24-9.
What is the molecular formula of 4G-910?
The molecular formula of 4G-910 is C16H13F3N2O7.
What is the molecular weight of 4G-910?
The molecular weight of 4G-910 is 402.07 g/mol.
Where can I buy 4G-910?
You can request a quote for 4G-910 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4G-910?
Yes, KEHONG BIO provides custom synthesis services for 4G-910 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.