TL;DR: 1,4-Benzodioxin-2-ol, 2,3-dihydro-3,3-dimethyl-2-(2-pyridinyl)- (CAS 137838-46-1) is a chemical compound with molecular formula C15H15NO3 and molecular weight 257.1052 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2-dimethyl-3-pyridin-2-yl-1,4-benzodioxin-3-ol
Also Known As: 2,2-dimethyl-3-pyridin-2-yl-1,4-benzodioxin-3-ol, 1,4-Benzodioxin-2-ol, 2,3-dihydro-3,3-dimethyl-2-(2-pyridinyl)-, 1,4-Benzodioxin-2-ol,2,3-dihydro-3,3-dimethyl-2-(2-pyridinyl), 3,3-Dimethyl-2-(pyridin-2-yl)-2,3-dihydro-1,4-benzodioxin-2-ol, 9,9-dimethyl-8-pyridin-2-yl-7,10-dioxabicyclo[4.4.0]deca-1,3,5-trien-8-ol
| Molecular Formula | C15H15NO3 |
| Molecular Weight | 257.1052 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 51.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 257.1052 Da |
| Heavy Atoms | 19 |
| Complexity | 333.0 |
| SMILES | CC1(C(OC2=CC=CC=C2O1)(C3=CC=CC=N3)O)C |
| InChIKey | DHILTVHLZQMNLQ-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Benzodioxin-2-ol, 2,3-dihydro-3,3-dimethyl-2-(2-pyridinyl)-. With a topological polar surface area (TPSA) of 51.6 Ų, 1,4-Benzodioxin-2-ol, 2,3-dihydro-3,3-dimethyl-2-(2-pyridinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Benzodioxin-2-ol, 2,3-dihydro-3,3-dimethyl-2-(2-pyridinyl)- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,4-Benzodioxin-2-ol, 2,3-dihydro-3,3-dimethyl-2-(2-pyridinyl)- is 137838-46-1.
The molecular formula of 1,4-Benzodioxin-2-ol, 2,3-dihydro-3,3-dimethyl-2-(2-pyridinyl)- is C15H15NO3.
The molecular weight of 1,4-Benzodioxin-2-ol, 2,3-dihydro-3,3-dimethyl-2-(2-pyridinyl)- is 257.1052 g/mol.
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