BAS 12946004
TL;DR: BAS 12946004 (CAS 1093408-00-4) is a chemical compound with molecular formula C20H27NO6 and molecular weight 377.18384 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3,5-dimethylphenyl)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecane-8-carboxamide
Also Known As: BAS 12946004, AS-871/43469459, N-(3,5-dimethylphenyl)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.0^{2,6}]dodecane-8-carboxamide, F3114-0041, N-(3,5-dimethylphenyl)-2,2,7,7-tetramethyltetrahydro-3aH-bis([1,3]dioxolo)[4,5-b:4',5'-d]pyran-5-carboxamide
Technical Specifications
| Molecular Formula | C20H27NO6 |
| Molecular Weight | 377.18384 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 75.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 377.18384 Da |
| Heavy Atoms | 27 |
| Complexity | 583.0 |
| SMILES | CC1=CC(=CC(=C1)NC(=O)C2C3C(C4C(O2)OC(O4)(C)C)OC(O3)(C)C)C |
| InChIKey | NMPFJWNIAMWBKN-UHFFFAOYSA-N |
Chemical Property Profile of BAS 12946004
Property Insights of BAS 12946004
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12946004. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12946004. Following Lipinski's Rule of Five, BAS 12946004 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
What is the CAS number of BAS 12946004?
The CAS number of BAS 12946004 is 1093408-00-4.
What is the molecular formula of BAS 12946004?
The molecular formula of BAS 12946004 is C20H27NO6.
What is the molecular weight of BAS 12946004?
The molecular weight of BAS 12946004 is 377.18384 g/mol.
Where can I buy BAS 12946004?
You can request a quote for BAS 12946004 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BAS 12946004?
Yes, CoreyChem provides custom synthesis services for BAS 12946004 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.