TL;DR: BAS 03281331 (CAS 1093406-45-1) is a chemical compound with molecular formula C20H25NO8 and molecular weight 407.15802 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecane-8-carboxamide
Also Known As: BAS 03281331, F1507-0136, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,2,7,7-tetramethyltetrahydro-3aH-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-carboxamide (non-preferred name), 2,2,7,7-Tetramethyl-tetrahydro-bis[1,3]dioxolo[4,5-b;4',5'-d]pyran-5-carboxylic, N-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-2,2,7,7-TETRAMETHYLTETRAHYDRO-3AH-BIS[1,3]DIOXOLO[4,5-B:4',5'-D]PYRAN-5-CARBOXAMIDE
| Molecular Formula | C20H25NO8 |
| Molecular Weight | 407.15802 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 93.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 407.15802 Da |
| Heavy Atoms | 29 |
| Complexity | 654.0 |
| SMILES | CC1(OC2C(O1)C(OC3C2OC(O3)(C)C)C(=O)NC4=CC5=C(C=C4)OCCO5)C |
| InChIKey | OLTGMPCSJLZDJI-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 03281331. The TPSA of 93.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03281331. Following Lipinski's Rule of Five, BAS 03281331 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BAS 03281331 is 1093406-45-1.
The molecular formula of BAS 03281331 is C20H25NO8.
The molecular weight of BAS 03281331 is 407.15802 g/mol.
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