TL;DR: 1-(2,4-dichlorophenoxy)-3-(2-imino-3-propyl-2,3-dihydro-1H-benzo[d]imidazol-1-yl)propan-2-ol hydrochloride (CAS 1049711-80-9) is a chemical compound with molecular formula C19H22Cl3N3O2 and molecular weight 429.07776 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2,4-dichlorophenoxy)-3-(2-imino-3-propylbenzimidazol-1-yl)propan-2-ol;hydrochloride
Also Known As: 1-(2,4-dichlorophenoxy)-3-(2-imino-3-propyl-2,3-dihydro-1H-benzo[d]imidazol-1-yl)propan-2-ol hydrochloride, 1-(2,4-dichlorophenoxy)-3-(2-imino-3-propyl-benzoimidazol-1-yl)propan-2-ol Hydrochloride, 1-(2,4-dichlorophenoxy)-3-(2-imino-3-propylbenzimidazol-1-yl)propan-2-ol hydrochloride
| Molecular Formula | C19H22Cl3N3O2 |
| Molecular Weight | 429.07776 g/mol |
| XLogP | 4.50077 |
| Topological Polar Surface Area (TPSA) | 59.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 429.07776 Da |
| Heavy Atoms | 27 |
| Complexity | 482.0 |
| SMILES | CCCN1C2=CC=CC=C2N(C1=N)CC(COC3=C(C=C(C=C3)Cl)Cl)O.Cl |
| InChIKey | LQXDBJQKXBPLBA-UHFFFAOYSA-N |
The XLogP value of 4.50077 indicates that 1-(2,4-dichlorophenoxy)-3-(2-imino-3-propyl-2,3-dihydro-1H-benzo[d]imidazol-1-yl)propan-2-ol hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.8 Ų, 1-(2,4-dichlorophenoxy)-3-(2-imino-3-propyl-2,3-dihydro-1H-benzo[d]imidazol-1-yl)propan-2-ol hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,4-dichlorophenoxy)-3-(2-imino-3-propyl-2,3-dihydro-1H-benzo[d]imidazol-1-yl)propan-2-ol hydrochloride has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(2,4-dichlorophenoxy)-3-(2-imino-3-propyl-2,3-dihydro-1H-benzo[d]imidazol-1-yl)propan-2-ol hydrochloride is 1049711-80-9.
The molecular formula of 1-(2,4-dichlorophenoxy)-3-(2-imino-3-propyl-2,3-dihydro-1H-benzo[d]imidazol-1-yl)propan-2-ol hydrochloride is C19H22Cl3N3O2.
The molecular weight of 1-(2,4-dichlorophenoxy)-3-(2-imino-3-propyl-2,3-dihydro-1H-benzo[d]imidazol-1-yl)propan-2-ol hydrochloride is 429.07776 g/mol.
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