TL;DR: 2-Propanol, 1-[4-(hydroxyamino)phenoxy]-3-[(1-methylethyl)amino]- (CAS 114460-13-8) is a chemical compound with molecular formula C12H20N2O3 and molecular weight 240.1474 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4-(hydroxyamino)phenoxy]-3-(propan-2-ylamino)propan-2-ol
Also Known As: 2-Propanol, 1-[4-(hydroxyamino)phenoxy]-3-[(1-methylethyl)amino]-, 1-[4-(hydroxyamino)phenoxy]-3-(propan-2-ylamino)propan-2-ol, 1-(4-(Hydroxyamino)phenoxy)-3-(isopropylamino)propan-2-ol, 1-[4-(hydroxyamino)phenoxy]-3-[(propan-2-yl)amino]propan-2-ol, A11229
| Molecular Formula | C12H20N2O3 |
| Molecular Weight | 240.1474 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 73.8 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 240.1474 Da |
| Heavy Atoms | 17 |
| Complexity | 194.0 |
| SMILES | CC(C)NCC(COC1=CC=C(C=C1)NO)O |
| InChIKey | UCGFOKKVSOLRAB-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propanol, 1-[4-(hydroxyamino)phenoxy]-3-[(1-methylethyl)amino]-. The TPSA of 73.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propanol, 1-[4-(hydroxyamino)phenoxy]-3-[(1-methylethyl)amino]-. Following Lipinski's Rule of Five, 2-Propanol, 1-[4-(hydroxyamino)phenoxy]-3-[(1-methylethyl)amino]- has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Propanol, 1-[4-(hydroxyamino)phenoxy]-3-[(1-methylethyl)amino]- is 114460-13-8.
The molecular formula of 2-Propanol, 1-[4-(hydroxyamino)phenoxy]-3-[(1-methylethyl)amino]- is C12H20N2O3.
The molecular weight of 2-Propanol, 1-[4-(hydroxyamino)phenoxy]-3-[(1-methylethyl)amino]- is 240.1474 g/mol.
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