3M-938
TL;DR: 3M-938 (CAS 318237-94-4) is a chemical compound with molecular formula C22H23F3N4O5 and molecular weight 480.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(cyclohexylcarbamoyl)-4,6-dioxo-5-[3-(trifluoromethyl)phenyl]-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
Also Known As: 3M-938, ethyl 1-[(cyclohexylamino)carbonyl]-4,6-dioxo-5-[3-(trifluoromethyl)phenyl]-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate, ethyl 1-(cyclohexylcarbamoyl)-4,6-dioxo-5-[3-(trifluoromethyl)phenyl]-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate, ethyl 1-(cyclohexylcarbamoyl)-4,6-dioxo-5-[3-(trifluoromethyl)phenyl]-1H,3aH,4H,5H,6H,6aH-pyrrolo[3,4-c]pyrazole-3-carboxylate, ethyl1-(cyclohexylcarbamoyl)-4,6-dioxo-5-[3-(trifluoromethyl)phenyl]-1H,3aH,4H,5H,6H,6aH-pyrrolo[3,4-c]pyrazole-3-carboxylate
| Molecular Formula | C22H23F3N4O5 |
|---|---|
| Molecular Weight | 480.16 g/mol |
| LogP | 2.8404 |
| Topological Polar Surface Area | 108.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 480.16205 |
| Heavy Atoms | 34 |
| Complexity | 1051.2208 |
Chemical Identifiers
| CAS Number | 318237-94-4 |
|---|---|
| SMILES | CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)C3=CC=CC(=C3)C(F)(F)F)C(=O)NC4CCCCC4 |
Product Overview
3M-938 (CAS 318237-94-4), with molecular formula C22H23F3N4O5 and molecular weight 480.16 g/mol. IUPAC: ethyl 1-(cyclohexylcarbamoyl)-4,6-dioxo-5-[3-(trifluoromethyl)phenyl]-3a,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate.
Chemical Property Profile of 3M-938
Property Insights of 3M-938
The XLogP value of 2.8404 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3M-938. The TPSA of 108.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 3M-938. Following Lipinski's Rule of Five, 3M-938 has 1 hydrogen bond donor(s) and 6 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 3M-938?
The CAS number of 3M-938 is 318237-94-4.
What is the molecular formula of 3M-938?
The molecular formula of 3M-938 is C22H23F3N4O5.
What is the molecular weight of 3M-938?
The molecular weight of 3M-938 is 480.16 g/mol.
Where can I buy 3M-938?
You can request a quote for 3M-938 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3M-938?
Yes, KEHONG BIO provides custom synthesis services for 3M-938 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.