BAS 05017463
TL;DR: BAS 05017463 (CAS 1093405-84-5) is a chemical compound with molecular formula C19H22F3NO6 and molecular weight 417.13992 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,4,11,11-tetramethyl-N-[3-(trifluoromethyl)phenyl]-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecane-8-carboxamide
Also Known As: BAS 05017463, 4,4,11,11-tetramethyl-N-[3-(trifluoromethyl)phenyl]-3,5,7,10,12-pentaoxatricyclo[7.3.0.0^{2,6}]dodecane-8-carboxamide, 2,2,7,7-Tetramethyl-tetrahydro-bis[1,3]dioxolo[4,5-b;4',5'-d]pyran-5-carboxylic, (4,4,11,11-tetramethyl-3,5,8,10,12-pentaoxatricyclo[7.3.0.0<2,6>]dodec-7-yl)-N -[3-(trifluoromethyl)phenyl]carboxamide, 2,2,7,7-tetramethyl-N-[3-(trifluoromethyl)phenyl]tetrahydro-3aH-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-carboxamide (non-preferred name)
Technical Specifications
| Molecular Formula | C19H22F3NO6 |
| Molecular Weight | 417.13992 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 75.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 417.13992 Da |
| Heavy Atoms | 29 |
| Complexity | 654.0 |
| SMILES | CC1(OC2C(O1)C(OC3C2OC(O3)(C)C)C(=O)NC4=CC=CC(=C4)C(F)(F)F)C |
| InChIKey | JPMRKXGFGGGORQ-UHFFFAOYSA-N |
Chemical Property Profile of BAS 05017463
Property Insights of BAS 05017463
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 05017463. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05017463. Following Lipinski's Rule of Five, BAS 05017463 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of BAS 05017463?
The CAS number of BAS 05017463 is 1093405-84-5.
What is the molecular formula of BAS 05017463?
The molecular formula of BAS 05017463 is C19H22F3NO6.
What is the molecular weight of BAS 05017463?
The molecular weight of BAS 05017463 is 417.13992 g/mol.
Where can I buy BAS 05017463?
You can request a quote for BAS 05017463 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BAS 05017463?
Yes, CoreyChem provides custom synthesis services for BAS 05017463 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.